SCHEMBL23536154

SCHEMBL23536154

O=C(c1ccccc1N1CCC(c2ccc(Cl)cc2F)CC1)C(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 4/20 0.42
GRM2 Q14416 7/20 0.40
PROKR1 Q8TCW9 1/20 0.39
RBP4 P02753 3/20 0.39
CNR1 P21554 2/20 0.38
ALDH1A1 P00352 1/20 0.37
L3MBTL1 Q9Y468 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
SCHEMBL23536030 0.78 GRM2 (0.43) OPRL1GRM2
SCHEMBL23536314 0.78 GRM2 (0.43) OPRL1GRM2
SCHEMBL23536137 0.77 GRM2 (0.42) OPRL1GRM2
SCHEMBL23536100 0.77 MEN1 (0.49) OPRL1GRM2ALDH1A1
SCHEMBL29948480 0.76 GPR55 (0.38) OPRL1CNR1ALDH1A1L3MBTL1
SCHEMBL23536358 0.76 GPR55 (0.38) OPRL1CNR1ALDH1A1L3MBTL1
SCHEMBL28867411 0.75 OPRL1 (0.42) OPRL1GRM2ALDH1A1
SCHEMBL29931877 0.75 CA2 (0.43) OPRL1GRM2
SCHEMBL23536378 0.74 GRM2 (0.43) OPRL1GRM2
SCHEMBL29932127 0.74 GRM2 (0.43) OPRL1GRM2

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