SCHEMBL24677050

SCHEMBL24677050

Cc1csc(C2CC(O)C2)n1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
OGA O60502 1/20 0.36
CNR2 P34972 1/20 0.36
TRPV1 Q8NER1 7/20 0.35
HSD11B1 P28845 1/20 0.35
RAB9A P51151 1/20 0.35
EPHX2 P34913 2/20 0.34
NPC1 O15118 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GRM5 P41594 1/20 0.33

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
SCHEMBL6840373 0.79
Ammonia Solution, Strong SCHEMBL27924535 0.78 OGA (0.45) NOS1SMN1; SMN2OGATRPV1HSD11B1
SCHEMBL12791651 0.76 OGA (0.44) NOS1SMN1; SMN2OGAHSD11B1RAB9A
SCHEMBL14212540 0.75 HSD11B1 (0.37) NOS1SMN1; SMN2OGACNR2TRPV1
SCHEMBL10217223 0.74 SSTR4 (0.39) NOS1SMN1; SMN2OGATRPV1HSD11B1
SCHEMBL5291304 0.74 RAB9A (0.46) NOS1SMN1; SMN2OGAHSD11B1RAB9A
SCHEMBL24676000 0.74 OGA (0.40) NOS1SMN1; SMN2OGATRPV1HSD11B1
SCHEMBL26384520 0.74 SCN10A (0.36) NOS1SMN1; SMN2CNR2TRPV1RAB9A
SCHEMBL24676730 0.73 SMN1; SMN2 (0.38) NOS1SMN1; SMN2OGATRPV1HSD11B1
SCHEMBL21314668 0.73 TRPV1 (0.39) TRPV1

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
WO-2022155941-A1 CDK2 INHIBITORS QILU REGOR THERAPEUTICS INC. (CN) 2022-07-28 WO disclosed