SCHEMBL28867404

SCHEMBL28867404

Cc1ccccc1S(=O)(=O)c1ccccc1N1CCC(c2ccc(Cl)cc2F)CC1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
HTT P42858 1/20 0.39
GRM2 Q14416 5/20 0.39
DRD2 P14416 4/20 0.38
ADRA1D P25100 3/20 0.38
ADRA1A P35348 3/20 0.38
ADRA1B P35368 3/20 0.38
DRD1 P21728 1/20 0.38
OPRL1 P41146 2/20 0.38
AVPR1A P37288 3/20 0.38
TP53 P04637 2/20 0.37
MAPT P10636 1/20 0.37
POLB P06746 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
NPSR1 Q6W5P4 1/20 0.36
GPBAR1 Q8TDU6 1/20 0.36

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
SCHEMBL29948574 0.88 POLB (0.42) LMNATSHRMAPK1HTTGRM2
SCHEMBL23536112 0.88 POLB (0.42) LMNATSHRMAPK1HTTGRM2
SCHEMBL29931915 0.87 ALDH1A1 (0.39) LMNAHTTGRM2DRD2ADRA1D
SCHEMBL29931877 0.84 CA2 (0.43) GRM2DRD2ADRA1DADRA1AADRA1B
SCHEMBL23536117 0.83 POLB (0.41) LMNAHTTGRM2TP53POLB
SCHEMBL29931921 0.83 POLB (0.41) LMNAHTTGRM2TP53POLB
SCHEMBL23536108 0.81 PGR (0.43) LMNADRD2ADRA1DADRA1AADRA1B
SCHEMBL29931982 0.81 PGR (0.43) LMNADRD2ADRA1DADRA1AADRA1B
SCHEMBL29931965 0.81 GRM2 (0.41) GRM2DRD2ADRA1DADRA1AADRA1B
SCHEMBL29931984 0.76 CYP1A2 (0.39) HTTGRM2DRD2ADRA1DADRA1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115087440-A TRPML modulators 卡斯玛治疗公司 2022-09-20 CN disclosed