SCHEMBL23536378

SCHEMBL23536378

Fc1cc(Cl)ccc1C1CCN(c2ccccc2CBr)CC1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 10/20 0.43
OPRL1 P41146 5/20 0.42
HTR2A P28223 1/20 0.39
HTR2C P28335 1/20 0.39
HTR2B P41595 1/20 0.39
C5AR1 P21730 1/20 0.38
DRD2 P14416 1/20 0.37
DRD4 P21917 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL29932127 1.00 GRM2 (0.43) GRM2OPRL1HTR2AHTR2CHTR2B
SCHEMBL23536030 0.89 GRM2 (0.43) GRM2OPRL1KMT2A
SCHEMBL23536137 0.81 GRM2 (0.42) GRM2OPRL1
SCHEMBL23536100 0.81 MEN1 (0.49) GRM2OPRL1HTR2AHTR2CHTR2B
SCHEMBL23536068 0.80 OPRL1 (0.41) GRM2OPRL1C5AR1DRD2KMT2A
SCHEMBL29932148 0.80 OPRL1 (0.38) GRM2OPRL1DRD4KMT2A
SCHEMBL23536392 0.80 OPRL1 (0.38) GRM2OPRL1DRD4KMT2A
SCHEMBL23536325 0.79 GRM2 (0.44) GRM2
SCHEMBL29931899 0.79 GRM2 (0.44) GRM2
SCHEMBL23536314 0.79 GRM2 (0.43) GRM2OPRL1

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