SCHEMBL1701340

SCHEMBL1701340

Cc1c(Br)cccc1CC=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 2/20 0.40
GABRB2 P47870 2/20 0.40
TSHR P16473 2/20 0.34
TAAR1 Q96RJ0 3/20 0.33
ALDH1A1 P00352 2/20 0.33
NPC1 O15118 1/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2D6 P10635 1/20 0.32
NFKB1 P19838 1/20 0.32
CYP2C19 P33261 1/20 0.32
HSD17B10 Q99714 1/20 0.32
IDO1 P14902 2/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
LMNA P02545 1/20 0.31
BLM P54132 1/20 0.31

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
SCHEMBL3707678 0.80 PTGS2 (0.36) TAAR1ALDH1A1MAPTCYP1A2CYP2C19
SCHEMBL13263824 0.79 GABRA1 (0.43) GABRA1GABRB2TAAR1HTTSMN1; SMN2
SCHEMBL3364100 0.79 ESR1 (0.41) GABRA1GABRB2TSHRTAAR1ALDH1A1
SCHEMBL28879956 0.79 GABRA1 (0.43) GABRA1GABRB2TSHRTAAR1ALDH1A1
SCHEMBL7322742 0.79 GABRA1 (0.58) GABRA1GABRB2TSHRTAAR1ALDH1A1
SCHEMBL166137 0.79 TAAR1 (0.46) GABRA1GABRB2TSHRTAAR1ALDH1A1
SCHEMBL29566515 0.79 TAAR1 (0.46) GABRA1GABRB2TSHRTAAR1ALDH1A1
SCHEMBL1849111 0.76 GABRA1 (0.35) GABRA1GABRB2TSHRTAAR1IDO1
SCHEMBL430886 0.76 CA2 (0.43) GABRA1GABRB2ALDH1A1MAPTHTT
SCHEMBL4619300 0.76 GABRA1 (0.45) GABRA1GABRB2TSHRTAAR1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11702418-B2 SOS1 inhibitors Mirati Therapeutics, Inc. (US) 2023-07-18 US disclosed
EP-4076418-A1 SOS1 INHIBITORS Mirati Therapeutics, Inc. (US) 2022-10-26 EP disclosed
US-20210188857-A1 SOS1 INHIBITORS Mirati Therapeutics, Inc. 2021-06-24 US disclosed
WO-2021127429-A1 SOS1 INHIBITORS Mirati Therapeutics, Inc. (US) 2021-06-24 WO disclosed
EP-3452476-A1 HETEROCYCLIC COMPOUNDS AS IMMUNOMODULATORS Incyte Holdings Corporation (US) 2019-03-13 EP disclosed
EP-3365340-A1 HETEROCYCLIC COMPOUNDS AS IMMUNOMODULATORS Incyte Corporation (US) 2018-08-29 EP disclosed
WO-2017192961-A1 HETEROCYCLIC COMPOUNDS AS IMMUNOMODULATORS INCYTE CORPORATION (US) 2017-11-09 WO disclosed
WO-2017070089-A1 HETEROCYCLIC COMPOUNDS AS IMMUNOMODULATORS INCYTE CORPORATION (US) 2017-04-27 WO disclosed
EP-2847174-A1 PYRIMIDINONE CARBOXAMIDES AS INHIBITORS OF ENDOTHELIAL LIPASE Bristol-Myers Squibb Company (US) 2015-03-18 EP disclosed
WO-2013151923-A1 PYRIMIDINONE CARBOXAMIDES AS INHIBITORS OF ENDOTHELIAL LIPASE BRISTOL-MYERS SQUIBB COMPANY (US) 2013-10-10 WO disclosed
EP-1888063-A1 ANTIFUNGAL AGENTS F2G Ltd. (GB) 2008-02-20 EP disclosed
WO-2006123145-A1 ANTIFUNGAL AGENTS F2G LTD (GB) 2006-11-23 WO disclosed
EP-1658288-A1 2-AMINO-5-BENZOYLTHIAZOLE NPY ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2006-05-24 EP disclosed
WO-2005014592-A1 2-AMINO-5-BENZOYLTHIAZOLE NPY ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2005-02-17 WO disclosed
EP-1443934-A1 BENZOTRIAZEPINES AS GASTRIN AND CHOLECYSTOKININ RECEPTOR LIGANDS JAMES BLACK FOUNDATION LIMITED (GB) 2004-08-11 EP disclosed
WO-2003041714-A1 BENZOTRIAZEPINES AS GASTRIN AND CHOLECYSTOKININ RECEPTOR LIGANDS JAMES BLACK FOUNDATION LIMITED (GB) 2003-05-22 WO disclosed
US-4417052-A ANTIINFLAMMATORY AGENTS; ANALGESICS; VIRICIDES STERLING DRUG INC. (US) 1983-11-22 US disclosed
US-4308382-A ANTIINFLAMMATORY AGENTS STERLING DRUG INC. (US) 1981-12-29 US disclosed
US-4216326-A Intermediates for preparing anti-inflammatory phenyl-lower-alkylamines STERLING DRUG INC. (US) 1980-08-05 US disclosed
US-4069256-A Anti-inflammatory phenyl-lower-alkylamines STERLING DRUG INC. (US) 1978-01-17 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 (2 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-20210188857-A1 SOS1 INHIBITORS SOS1, SOS2, SOST GABRA1 3926/4885GABRB2 4067/4885TSHR 3618/4885
US-11702418-B2 SOS1 inhibitors SOS1, SOS2, SOST GABRA1 3926/4885GABRB2 4067/4885TSHR 3618/4885

“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.