SCHEMBL25796522

SCHEMBL25796522

CN1CCc2nc(S(N)(=O)=O)sc2C1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 1/20 0.45
F10 P00742 4/20 0.38
F2 P00734 2/20 0.38
RAD52 P43351 2/20 0.38
RECQL P46063 1/20 0.38
NPC1 O15118 3/20 0.37
RAB9A P51151 3/20 0.37
CYP2C19 P33261 2/20 0.37
HPGD P15428 2/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2D6 P10635 1/20 0.37
KMT2A Q03164 5/20 0.36
KDM4E B2RXH2 5/20 0.36
ALDH1A1 P00352 4/20 0.36
MAPT P10636 3/20 0.36
MEN1 O00255 2/20 0.36
ADORA1 P30542 1/20 0.36
GLA P06280 1/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 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
SCHEMBL31054273 0.98 GRM5 (0.44) GRM5F10F2RAD52RECQL
SCHEMBL3007282 0.84 GRM5 (0.45) GRM5F10F2RAD52RECQL
SCHEMBL114205 0.75 RAD52 (0.63) GRM5RAD52RECQLNPC1RAB9A
SCHEMBL5776887 0.74 GRM5 (0.47) GRM5F10F2RAD52RECQL
Bromide SCHEMBL1253502 0.73 RAD52 (0.61) GRM5RAD52RECQLNPC1RAB9A
SCHEMBL209848 0.73 GRM5 (0.51) GRM5F10F2RAD52RECQL
SCHEMBL8051769 0.73 GRM5 (0.51) GRM5F10F2RAD52RECQL
SCHEMBL9096033 0.73 APOBEC3A (0.50) GRM5NPC1RAB9AKMT2AALDH1A1
SCHEMBL25797005 0.72 ALOX15 (0.45) GRM5F10F2NPC1RAB9A
SCHEMBL765133 0.72 F10 (0.49) GRM5F10F2HPGDKMT2A

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-2023116812-A1 SULFONYLUREA COMPOUND 瑞石生物医药有限公司 2023-06-29 WO disclosed