SCHEMBL2768950

SCHEMBL2768950

COC(=O)C1CCN1Cc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 1/20 0.54
LTA4H P09960 2/20 0.53
ALDH1A1 P00352 2/20 0.49
NPSR1 Q6W5P4 2/20 0.49
MAPT P10636 1/20 0.49
HPGD P15428 1/20 0.49
HSD17B10 Q99714 1/20 0.49
KMT2A Q03164 2/20 0.48
MEN1 O00255 1/20 0.48
GBA1 P04062 1/20 0.48
CYP3A4 P08684 2/20 0.46
KDM4E B2RXH2 1/20 0.46
POLB P06746 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
SCHEMBL19465330 0.91 LTA4H (0.63) FKBP1ALTA4HALDH1A1NPSR1KMT2A
SCHEMBL952721 0.91 LTA4H (0.63) FKBP1ALTA4HALDH1A1NPSR1KMT2A
SCHEMBL952722 0.91 LTA4H (0.63) FKBP1ALTA4HALDH1A1NPSR1KMT2A
SCHEMBL20312897 0.90 SIGMAR1 (0.51) FKBP1ALTA4H
SCHEMBL7181767 0.90 MEN1 (0.60) FKBP1ALTA4HALDH1A1KMT2AMEN1
SCHEMBL6540812 0.90 MEN1 (0.60) FKBP1ALTA4HALDH1A1KMT2AMEN1
SCHEMBL2919874 0.88 CYP3A4 (0.53) FKBP1ALTA4HALDH1A1NPSR1MAPT
SCHEMBL2919878 0.88 CYP3A4 (0.53) FKBP1ALTA4HALDH1A1NPSR1MAPT
SCHEMBL2919871 0.88 CYP3A4 (0.53) FKBP1ALTA4HALDH1A1NPSR1MAPT
SCHEMBL2769632 0.87 CYP3A4 (0.54) LTA4HALDH1A1CYP3A4KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11548888-B2 KRas G12C inhibitors Mirati Therapeutics, Inc. (US) 2023-01-10 US disclosed
US-11548888-B2 KRas G12C inhibitors Mirati Therapeutics, Inc. (US) 2023-01-10 US disclosed
EP-4087573-A1 KRAS G12C INHIBITORS Mirati Therapeutics, Inc. (US) 2022-11-16 EP disclosed
EP-3908283-A1 KRAS G12C INHIBITORS Mirati Therapeutics, Inc. (US) 2021-11-17 EP disclosed
US-20200331911-A1 KRAS G12C INHIBITORS Mirati Therapeutics, Inc. 2020-10-22 US disclosed
US-20200331911-A1 KRAS G12C INHIBITORS Mirati Therapeutics, Inc. 2020-10-22 US disclosed
WO-2020146613-A1 KRAS G12C INHIBITORS Mirati Therapeutics, Inc. (US) 2020-07-16 WO disclosed
WO-2020146613-A1 KRAS G12C INHIBITORS Mirati Therapeutics, Inc. (US) 2020-07-16 WO disclosed
US-9375423-B2 Use of aminoindane compounds in treating overactive bladder and interstitial cystitis ASANA BIOSCIENCES, LLC (US) 2016-06-28 US disclosed
US-20150290182-A1 USE OF AMINOINDANE COMPOUNDS IN TREATING OVERACTIVE BLADDER AND INTERSTITIAL CYSTITIS ASANA BIOSCIENCES, LLC (US) 2015-10-15 US disclosed
US-20020164727-A1 Nucleotide sequences coding polypeptide for use as tool in genetic engineering SUMITOMO CHEMICAL COMPANY, LIMITED 2002-11-07 US disclosed
US-6410279-B1 GENERATING PREFERENTIAL COMPOUND IN SOLUTION; OBTAIN N-SUBSTITUTED AZETIDINE-2-CARBOXYLIC ACID ESTER, INCUBATE WITH PREFERENTIAL ENZYME, RECOVER COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-06-25 US disclosed
EP-1201653-A1 Method for racemization of optically active azetidine-2-Carboxylate SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-05-02 EP disclosed
EP-1181273-A1 NEW PROCESS AstraZeneca AB (SE) 2002-02-27 EP disclosed
US-6166224-A Method for racemization of optically active azetidine-2-carboxylate SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-12-26 US disclosed
US-6162621-A Process for producing optically active azetidine-2-carboxylic acid derivative SUMITOMO CHEMICAL COMPANY, LTD. (JP) 2000-12-19 US disclosed
EP-1057894-A2 Esterase genes and uses of the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-12-06 EP disclosed
WO-2000068193-A1 NEW PROCESS ASTRAZENECA AB (SE) 2000-11-16 WO disclosed
EP-0957089-A1 Method for racemization of optically active azetidine-2-carboxylate SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-11-17 EP disclosed
EP-0855446-A2 Process for producing optically active azetidine-2-carboxylic acid derivative SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1998-07-29 EP 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 (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-20020164727-A1 Nucleotide sequences coding polypeptide for use as tool in genetic engineering IMPDH2, INHA, IMPDH1 FKBP1A 542/4885LTA4H 3520/4885ALDH1A1 2545/4885
US-11548888-B2 KRas G12C inhibitors KRAS, NRAS, HRAS FKBP1A 2577/4885LTA4H 3802/4885ALDH1A1 3370/4885
US-20200331911-A1 KRAS G12C INHIBITORS KRAS, NRAS, HRAS FKBP1A 2577/4885LTA4H 3802/4885ALDH1A1 3370/4885
US-20150290182-A1 USE OF AMINOINDANE COMPOUNDS IN TREATING OVERACTIVE BLADDER AND INTERSTITIAL CYSTITIS IDO1, IDO2, SLC1A2 FKBP1A 1055/4885LTA4H 483/4885ALDH1A1 547/4885

“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.