SCHEMBL23536100

SCHEMBL23536100

Nc1ccccc1N1CCC(c2ccc(Cl)cc2F)CC1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.49
USP2 O75604 1/20 0.49
GAA P10253 1/20 0.49
KMT2A Q03164 1/20 0.49
KEAP1 Q14145 1/20 0.43
GRM2 Q14416 6/20 0.42
OPRL1 P41146 4/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
HTT P42858 1/20 0.41
ADRA2C P18825 1/20 0.41
POLB P06746 1/20 0.40
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38
HTR2B P41595 1/20 0.38

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
SCHEMBL23536137 0.84 GRM2 (0.42) GRM2OPRL1
SCHEMBL23536159 0.83 OPRL1 (0.41) GRM2OPRL1HTR2AHTR2CHTR2B
SCHEMBL29931973 0.83 OPRL1 (0.41) GRM2OPRL1HTR2AHTR2CHTR2B
SCHEMBL23536030 0.82 GRM2 (0.43) KMT2AGRM2OPRL1
SCHEMBL28867411 0.82 OPRL1 (0.42) MEN1KMT2AGRM2OPRL1ALDH1A1
SCHEMBL23536314 0.82 GRM2 (0.43) GRM2OPRL1
SCHEMBL29931877 0.82 CA2 (0.43) GRM2OPRL1POLBHTR2AHTR2C
SCHEMBL29932127 0.81 GRM2 (0.43) KMT2AGRM2OPRL1HTR2AHTR2C
SCHEMBL23536378 0.81 GRM2 (0.43) KMT2AGRM2OPRL1HTR2AHTR2C
SCHEMBL23536288 0.80 OPRL1 (0.48) OPRL1HTR2AHTR2CHTR2B

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