SCHEMBL23536159

SCHEMBL23536159

Nc1cccc(Cl)c1N1CCC(c2ccc(Cl)cc2F)CC1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 5/20 0.41
HTR2A P28223 1/20 0.37
HTR2C P28335 1/20 0.37
HTR2B P41595 1/20 0.37
GRM2 Q14416 7/20 0.37
MALT1 Q9UDY8 1/20 0.37
NOTUM Q6P988 1/20 0.35
MAPT P10636 1/20 0.34
PROKR1 Q8TCW9 1/20 0.34
SSTR2 P30874 1/20 0.34
CNR1 P21554 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
SCHEMBL29931973 1.00 OPRL1 (0.41) OPRL1HTR2AHTR2CHTR2BGRM2
SCHEMBL23536100 0.83 MEN1 (0.49) OPRL1HTR2AHTR2CHTR2BGRM2
SCHEMBL23536127 0.80 ALDH1A1 (0.50) MAPT
SCHEMBL23536288 0.76 OPRL1 (0.48) OPRL1HTR2AHTR2CHTR2B
SCHEMBL29931894 0.76 OPRL1 (0.48) OPRL1HTR2AHTR2CHTR2B
SCHEMBL433273 0.73 OPRL1 (0.59) OPRL1HTR2AHTR2CHTR2BPROKR1
SCHEMBL4969208 0.73 OPRL1 (0.64) OPRL1HTR2AHTR2CHTR2BGRM2
SCHEMBL23043567 0.73 NOTUM (0.46) HTR2CNOTUM
SCHEMBL23043670 0.73 MEN1 (0.56) NOTUMMAPT
SCHEMBL29978740 0.73 NOTUM (0.46) HTR2CNOTUM

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 3 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
WO-2021127337-A1 TRPML MODULATORS CASMA THERAPEUTICS, INC. (US) 2021-06-24 WO disclosed