SCHEMBL29932014

SCHEMBL29932014

Fc1cc(Cl)ccc1C1CCC2(CC1)OCCO2

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 6/20 0.47
HTR2A P28223 1/20 0.42
HTR2C P28335 1/20 0.42
HTR2B P41595 1/20 0.42
ATM Q13315 1/20 0.39
TRPV3 Q8NET8 1/20 0.37
MAP3K14 Q99558 1/20 0.36
POLB P06746 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
LMNA P02545 2/20 0.35
MAPT P10636 2/20 0.35
FLT3 P36888 1/20 0.35
AVPR1A P37288 1/20 0.35
USP2 O75604 1/20 0.34
ALDH1A1 P00352 1/20 0.34
TSHR P16473 1/20 0.34

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
SCHEMBL17542866 1.00 OPRL1 (0.47) OPRL1HTR2AHTR2CHTR2BATM
SCHEMBL22816456 0.84 OPRL1 (0.45) OPRL1HTR2AHTR2CHTR2BTRPV3
SCHEMBL17543565 0.83 OPRL1 (0.45) OPRL1HTR2AHTR2CHTR2B
SCHEMBL17543564 0.83 OPRL1 (0.45) OPRL1HTR2AHTR2CHTR2B
SCHEMBL24753039 0.82 MAOA (0.35) OPRL1TRPV3NPC1RAB9AMAPT
SCHEMBL30120243 0.82 MAOA (0.35) OPRL1TRPV3NPC1RAB9AMAPT
SCHEMBL433273 0.80 OPRL1 (0.59) OPRL1HTR2AHTR2CHTR2BMAP3K14
SCHEMBL20011091 0.80 TRPV3 (0.39) OPRL1TRPV3NPC1RAB9AALDH1A1
SCHEMBL1528692 0.79 TRPV3 (0.35) OPRL1TRPV3NPC1RAB9AALDH1A1
SCHEMBL20011431 0.79 NPC1 (0.48) OPRL1HTR2AHTR2CHTR2BNPC1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4076423-A1 TRPML MODULATORS Casma Therapeutics, Inc. (US) 2022-10-26 EP disclosed
CN-115087440-A TRPML modulators 卡斯玛治疗公司 2022-09-20 CN disclosed