SCHEMBL8787652

SCHEMBL8787652

NC(=O)N1C(=O)C(=C(OCCc2ccccc2)c2cccs2)c2cc(F)c(Cl)cc21

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.35
BRCA1 P38398 1/20 0.35
NPC1 O15118 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
RAB9A P51151 1/20 0.33
HPGD P15428 1/20 0.33
PPARG P37231 1/20 0.33
PPARA Q07869 1/20 0.33
SCN9A Q15858 1/20 0.33
TP53 P04637 1/20 0.33
MDM2 Q00987 1/20 0.33
SCN5A Q14524 1/20 0.32
SCN2A Q99250 1/20 0.32
LMNA P02545 1/20 0.32
HSP90AA1 P07900 1/20 0.32
KMT2A Q03164 1/20 0.32
AADAT Q8N5Z0 1/20 0.32
GPR52 Q9Y2T5 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32

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
SCHEMBL9449534 1.00 GLA (0.35) GLABRCA1NPC1SMN1; SMN2RAB9A
SCHEMBL8787746 0.86 KMT2A (0.36) GLABRCA1NPC1SMN1; SMN2RAB9A
SCHEMBL8787452 0.85 SCN5A (0.33) GLABRCA1NPC1SCN5ASCN2A
SCHEMBL8787449 0.85 SCN5A (0.33) GLABRCA1NPC1SCN5ASCN2A
SCHEMBL8787617 0.84 NOS2 (0.33) GLABRCA1LMNA
SCHEMBL8787613 0.84 NOS2 (0.33) GLABRCA1LMNA
SCHEMBL8788043 0.84 KMT2A (0.34) GLABRCA1NPC1SMN1; SMN2RAB9A
SCHEMBL8788038 0.84 KMT2A (0.34) GLABRCA1NPC1SMN1; SMN2RAB9A
SCHEMBL8788781 0.83 LMNA (0.35) GLABRCA1NPC1SMN1; SMN2RAB9A
SCHEMBL8787717 0.83 KMT2A (0.36) NPC1SMN1; SMN2RAB9AHPGDLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0681580-B1 PRODRUGS OF ANTIINFLAMMATORY 3-ACYL-2-OXINDOLE-1-CARBOXAMIDES PFIZER (US) 1997-07-09 EP disclosed
US-5270331-A Prodrugs of antiinflammatory 3-acyl-2-oxindole-1-carboxamides PFIZER, INC. (US) 1993-12-14 US disclosed