SCHEMBL31592004

SCHEMBL31592004

Cc1ccc2nc(-c3ccc(C(c4ccc(S(C)(=O)=O)cc4)S(N)(=O)=O)cc3)sc2c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RORC P51449 7/20 0.60
MAPT P10636 8/20 0.56
GAA P10253 6/20 0.56
ALDH1A1 P00352 6/20 0.56
HPGD P15428 6/20 0.56
KDM4E B2RXH2 5/20 0.56
GLA P06280 4/20 0.56
APP P05067 5/20 0.55
NPC1 O15118 5/20 0.55
RAB9A P51151 5/20 0.55
CCNE1 P24864 1/20 0.53
CDK2 P24941 1/20 0.53
CDK5 Q00535 1/20 0.53
CDK5R1 Q15078 1/20 0.53
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
SMN1; SMN2 Q16637 3/20 0.53
HSP90AA1 P07900 1/20 0.53
LMNA P02545 2/20 0.51
NFKB1 P19838 1/20 0.51

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
SCHEMBL31591984 0.92 MAPT (0.61) RORCMAPTGAAALDH1A1HPGD
SCHEMBL31591998 0.86 RORC (0.62) RORCMAPTGAAALDH1A1HPGD
SCHEMBL31592002 0.85 MAPT (0.53) RORCMAPTGAAALDH1A1HPGD
SCHEMBL31592018 0.82 RORC (0.53) RORCMAPTGAAALDH1A1HPGD
SCHEMBL31591996 0.80 RORC (0.49) RORCMAPTGAAALDH1A1HPGD
SCHEMBL24186122 0.75 RORC (1.00) RORCMAPTGAAALDH1A1HPGD
SCHEMBL12619483 0.75 MAPT (0.73) RORCMAPTGAAALDH1A1HPGD
SCHEMBL12422217 0.75 MAPT (0.81) RORCMAPTGAAALDH1A1HPGD
SCHEMBL31592009 0.73 MAPT (0.58) RORCMAPTGAAALDH1A1HPGD
SCHEMBL21392914 0.73 MAPT (0.65) RORCMAPTGAAALDH1A1HPGD

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-113912563-B Benzo five-membered nitrogen heterocyclic compound and application thereof 中国科学院广州生物医药与健康研究院 2025-05-27 CN disclosed