SCHEMBL744528

SCHEMBL744528

CC1(C)Cc2ccc[c]c2O1

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.35
PKM P14618 2/20 0.32
NPSR1 Q6W5P4 1/20 0.32
ALDH1A1 P00352 2/20 0.30
KDM4E B2RXH2 1/20 0.30

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
SCHEMBL5535575 0.81 IDO1 (0.35) LMNANPSR1ALDH1A1KDM4E
SCHEMBL10613009 0.70
SCHEMBL8389886 0.69 ALDH1A1 (0.33) ALDH1A1KDM4E
SCHEMBL2551780 0.69 MAOA (0.41)
SCHEMBL20561800 0.68 SLC6A2 (0.33)
SCHEMBL1441712 0.67 PKM (0.41) LMNAPKMNPSR1ALDH1A1KDM4E
SCHEMBL4049816 0.67 HTR2A (0.30)
SCHEMBL8164070 0.65 ALDH1A1 (0.33) ALDH1A1
SCHEMBL9839124 0.65
SCHEMBL1486046 0.64

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023221952-A1 CYCLIC QUATERNARY AMMONIUM SALT COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF 宜昌人福药业有限责任公司 2023-11-23 WO claimed
US-20190070149-A1 PRIMARY AMINES AND DERIVATIVES THEREOF AS MODULATORS OF THE 5-HT2A SEROTONIN RECEPTOR USEFUL FOR THE TREATMENT OF DISORDERS RELATED THERETO ARENA PHARMACEUTICALS, INC. 2019-03-07 US claimed
US-9328107-B2 Primary amines and derivatives thereof as modulators of the 5-HT2A serotonin receptor useful for the treatment of disorders related thereto ARENA PHARMACEUTICALS, INC. (US) 2016-05-03 US claimed
EP-2018371-B1 PRIMARY AMINES AND DERIVATIVES THEREOF AS MODULATORS OF THE 5-HT2A SEROTONIN RECEPTOR USEFUL FOR THE TREATMENT OF DISORDERS RELATED THERETO ARENA PHARM INC (US) 2015-03-04 EP claimed
US-20140235622-A1 PRIMARY AMINES AND DERIVATIVES THEREOF AS MODULATORS OF THE 5-HT2A SEROTONIN RECEPTOR USEFUL FOR THE TREATMENT OF DISORDERS RELATED THERETO ARENA PHARMACEUTICALS, INC. (US) 2014-08-21 US claimed
US-8350028-B2 2-aminoquinolines HOFMANN-LA ROCHE INC. (US) 2013-01-08 US claimed
US-20120270861-A1 Primary Amines And Derivatives Thereof As Modulators Of The 5-HT2A Serotonin Receptor Useful For The Treatment Of Disorders Related Thereto ARENA PHARMACEUTICALS, INC. 2012-10-25 US claimed
US-7989628-B2 2-aminoquinolines HOFFMANN-LA ROCHE INC. (US) 2011-08-02 US claimed
EP-2268633-A1 PYRIDAZINONE GLUCOKINASE ACTIVATORS F. Hoffmann-La Roche AG (CH) 2011-01-05 EP claimed
US-20100099875-A1 NEW ORTHO-FUNCTIONALIZED P-CHIRAL ARYLPHOSPHINES AND DERIVATIVES: THEIR PREPARATION AND USE IN ASYMMETRIC CATALYSIS PHOSPHOENIX SARL (FR) 2010-04-22 US claimed
US-4272441-A CARBAMYLATION, PHOSGENE, ALCOHOL, AMINE FMC CORPORATION (US) 1981-06-09 US claimed
US-4263318-A INSECTICIDES THE REAGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1981-04-21 US claimed
US-4261897-A N-Chlorosulfinylcarbamate esters THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1981-04-14 US claimed
US-4262015-A INSECTICIDES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1981-04-14 US claimed
EP-0016590-A1 N-Sulfinyl carbamates, their use as pesticides, pesticidal compositions containing them, methods of producing them and halosulfinyl carbamates formed during their production THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1980-10-01 EP claimed
US-4201786-A INSECTICIDES, MITICIDES UNION CARBIDE CORPORATION (US) 1980-05-06 US claimed
US-4122204-A MITICIDES, INSECTICIDES UNION CARBIDE CORPORATION (US) 1978-10-24 US claimed
US-4086246-A REACTION OF PHOSGENE WITH A PHENOL AND PRIMARY AMINE CHINOIN GYOGYSZER ES VEGYESZETI TERMEKEK GYARA (HU) 1978-04-25 US claimed
US-4006231-A INSECTICIDE THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1977-02-01 US claimed
US-3997549-A INSECTICIDE THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1976-12-14 US claimed

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

For each of this compound's patents that has machine-readable text (4 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-20140235622-A1 PRIMARY AMINES AND DERIVATIVES THEREOF AS MODULATORS OF THE 5-HT2A SEROTONIN RECEPTOR USEFUL FOR THE TREATMENT OF DISORDERS RELATED THERETO HTR5A, HTR2A, HTR1A LMNA 2106/4885PKM 3821/4885NPSR1 41/4885
US-20100099875-A1 NEW ORTHO-FUNCTIONALIZED P-CHIRAL ARYLPHOSPHINES AND DERIVATIVES: THEIR PREPARATION AND USE IN ASYMMETRIC CATALYSIS PNP, NANP, PHOSPHO1 LMNA 4735/4885PKM 446/4885NPSR1 1952/4885
US-20190070149-A1 PRIMARY AMINES AND DERIVATIVES THEREOF AS MODULATORS OF THE 5-HT2A SEROTONIN RECEPTOR USEFUL FOR THE TREATMENT OF DISORDERS RELATED THERETO HTR5A, HTR2A, HTR1A LMNA 2106/4885PKM 3821/4885NPSR1 41/4885
US-20120270861-A1 Primary Amines And Derivatives Thereof As Modulators Of The 5-HT2A Serotonin Receptor Useful For The Treatment Of Disorders Related Thereto HTR5A, HTR2A, HTR1A LMNA 2106/4885PKM 3821/4885NPSR1 41/4885

“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.