SCHEMBL799468

SCHEMBL799468

Cc1ccc([C@H]2C[C@@H]2C(=O)O)cc1

nearest known ligand 0.81

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 6/20 0.81
ALDH1A1 P00352 5/20 0.64
CYP1A2 P05177 1/20 0.64
CYP3A4 P08684 1/20 0.64
CYP2C9 P11712 1/20 0.64
CYP2C19 P33261 1/20 0.64
FFAR4 Q5NUL3 4/20 0.53
TDP1 Q9NUW8 1/20 0.51
IDO1 P14902 2/20 0.46
LMNA P02545 2/20 0.46
TP53 P04637 2/20 0.46
HDAC4 P56524 1/20 0.46
HPGD P15428 1/20 0.46
MAPT P10636 1/20 0.45
ALOX12 P18054 1/20 0.45

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4209116 1.00 FFAR1 (0.81) FFAR1ALDH1A1CYP1A2CYP3A4CYP2C9
SCHEMBL19628622 1.00 FFAR1 (0.81) FFAR1ALDH1A1CYP1A2CYP3A4CYP2C9
SCHEMBL12466620 1.00 FFAR1 (0.81) FFAR1ALDH1A1CYP1A2CYP3A4CYP2C9
SCHEMBL301501 1.00 FFAR1 (0.81) FFAR1ALDH1A1CYP1A2CYP3A4CYP2C9
SCHEMBL4203114 1.00 FFAR1 (0.81) FFAR1ALDH1A1CYP1A2CYP3A4CYP2C9
SCHEMBL12646402 0.94 FFAR1 (0.73) FFAR1ALDH1A1CYP1A2CYP3A4CYP2C9
SCHEMBL1550383 0.90 FFAR1 (1.00) FFAR1ALDH1A1CYP1A2CYP3A4CYP2C9
SCHEMBL21845792 0.84 ALDH1A1 (0.64) FFAR1ALDH1A1CYP1A2CYP3A4CYP2C9
SCHEMBL799523 0.84 ALDH1A1 (0.64) FFAR1ALDH1A1CYP1A2CYP3A4CYP2C9
SCHEMBL16232159 0.84 ALDH1A1 (0.64) FFAR1ALDH1A1CYP1A2CYP3A4CYP2C9

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11021427-B2 Pd(II)-catalyzed enantioselective C—H arylation of free carboxylic acids THE SCRIPPS RESEARCH INSTITUTE (US) 2021-06-01 US disclosed
US-20180127406-A1 ARYLCYCLOPROPYLAMINE BASED DEMETHYLASE INHIBITORS OF LSD1 AND THEIR MEDICAL USE ORYZON GENOMICS SA (ES) 2018-05-10 US disclosed
US-9944601-B2 (Hetero)aryl cyclopropylamine compounds as LSD1 inhibitors ORYZON GENOMICS, S.A. (ES) 2018-04-17 US disclosed
US-20180079709-A1 (HETERO)ARYL CYCLOPROPYLAMINE COMPOUNDS AS LSD1 INHIBITORS ORYZON GENOMICS SA (ES) 2018-03-22 US disclosed
US-9708309-B2 Arylcyclopropylamine based demethylase inhibitors of LSD1 and their medical use ORYZON GENOMICS, S.A. (ES) 2017-07-18 US disclosed
US-9670136-B2 (Hetero)aryl cyclopropylamine compounds as LSD1 inhibitors ORYZON GENOMICS S.A. (ES) 2017-06-06 US disclosed
US-20170008844-A1 (HETERO)ARYL CYCLOPROPYLAMINE COMPOUNDS AS LSD1 INHIBITORS ORYZON GENOMICS S.A. (ES) 2017-01-12 US disclosed
US-20160368857-A1 (HETERO)ARYL CYCLOPROPYLAMINE COMPOUNDS AS LSD1 INHIBITORS ORYZON GENOMICS SA (ES) 2016-12-22 US disclosed
US-9487512-B2 (Hetero)aryl cyclopropylamine compounds as LSD1 inhibitors ORYZON GENOMICS S.A. (ES) 2016-11-08 US disclosed
US-9469597-B2 (Hetero)aryl cyclopropylamine compounds as LSD1 inhibitors ORYZON GENOMICS S.A. (ES) 2016-10-18 US disclosed
US-9181198-B2 Arylcyclopropylamine based demethylase inhibitors of LSD1 and their medical use ORYZON GENOMICS S.A. (ES) 2015-11-10 US disclosed
US-20150119396-A9 (HETERO)ARYL CYCLOPROPYLAMINE COMPOUNDS AS LSD1 INHIBITORS ORYZON GENOMICS S.A. (ES) 2015-04-30 US disclosed
US-9012452-B2 Processes for making cyclopropyl amide derivatives and intermediates associated therewith ASTRAZENECA AB (SE) 2015-04-21 US disclosed
US-20150025054-A1 (HETERO)ARYL CYCLOPROPYLAMINE COMPOUNDS AS LSD1 INHIBITORS ORYZON GENOMICS S.A. (ES) 2015-01-22 US disclosed
US-8853390-B2 Processes for preparing 1,2-substituted cyclopropyl derivatives ABBVIE INC. (US) 2014-10-07 US disclosed
US-20140256729-A1 (HETERO)ARYL CYCLOPROPYLAMINE COMPOUNDS AS LSD1 INHIBITORS ORYZON GENOMICS SA (ES) 2014-09-11 US disclosed
US-20130231342-A1 ARYLCYCLOPROPYLAMINE BASED DEMETHYLASE INHIBITORS OF LSD1 AND THEIR MEDICAL USE Oryzon Fenomics S.A. (ES) 2013-09-05 US disclosed
US-20130172560-A1 PROCESSES FOR MAKING CYCLOPROPYL AMIDE DERIVATIVES AND INTERMEDIATES ASSOCIATED THEREWITH ASTRAZENECA AB (SE) 2013-07-04 US disclosed
WO-2013007621-A1 POSITIVE ALLOSTERIC MODULATORS OF NICOTINIC ACETYLCHOLINE RECEPTOR H. LUNDBECK A/S (DK) 2013-01-17 WO disclosed
US-20120071651-A1 Processes for Preparing 1,2-Substituted Cyclopropyl Derivatives ABBOTT LABORATORIES (US) 2012-03-22 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (11 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160368857-A1 (HETERO)ARYL CYCLOPROPYLAMINE COMPOUNDS AS LSD1 INHIBITORS KDM1B, KDM1A, KDM2A FFAR1 3160/4885ALDH1A1 545/4885CYP1A2 141/4885
US-20150119396-A9 (HETERO)ARYL CYCLOPROPYLAMINE COMPOUNDS AS LSD1 INHIBITORS KDM1A, KDM1B, KDM3B FFAR1 2791/4885ALDH1A1 307/4885CYP1A2 181/4885
US-20180127406-A1 ARYLCYCLOPROPYLAMINE BASED DEMETHYLASE INHIBITORS OF LSD1 AND THEIR MEDICAL USE KDM6A, KDM1B, KDM1A FFAR1 2820/4885ALDH1A1 261/4885CYP1A2 78/4885
US-20130231342-A1 ARYLCYCLOPROPYLAMINE BASED DEMETHYLASE INHIBITORS OF LSD1 AND THEIR MEDICAL USE KDM6A, KDM1B, KDM1A FFAR1 2820/4885ALDH1A1 261/4885CYP1A2 78/4885
US-20170008844-A1 (HETERO)ARYL CYCLOPROPYLAMINE COMPOUNDS AS LSD1 INHIBITORS KDM1B, KDM1A, KDM2A FFAR1 3080/4885ALDH1A1 562/4885CYP1A2 148/4885
US-20130172560-A1 PROCESSES FOR MAKING CYCLOPROPYL AMIDE DERIVATIVES AND INTERMEDIATES ASSOCIATED THEREWITH HRH4, HRH2, HRH3 FFAR1 63/4885ALDH1A1 398/4885CYP1A2 151/4885
US-20140256729-A1 (HETERO)ARYL CYCLOPROPYLAMINE COMPOUNDS AS LSD1 INHIBITORS KDM1A, KDM1B, KDM3B FFAR1 2791/4885ALDH1A1 307/4885CYP1A2 181/4885
US-11021427-B2 Pd(II)-catalyzed enantioselective C—H arylation of free carboxylic acids PDCD1, PDK3, PDCD1LG2 FFAR1 119/4885ALDH1A1 135/4885CYP1A2 244/4885
US-20150025054-A1 (HETERO)ARYL CYCLOPROPYLAMINE COMPOUNDS AS LSD1 INHIBITORS KDM1B, KDM1A, KDM2A FFAR1 3080/4885ALDH1A1 562/4885CYP1A2 148/4885
US-20120071651-A1 Processes for Preparing 1,2-Substituted Cyclopropyl Derivatives HRH3, HRH4, HRH1 FFAR1 211/4885ALDH1A1 1799/4885CYP1A2 591/4885
US-20180079709-A1 (HETERO)ARYL CYCLOPROPYLAMINE COMPOUNDS AS LSD1 INHIBITORS KDM1B, KDM1A, KDM2A FFAR1 3160/4885ALDH1A1 545/4885CYP1A2 141/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.