SCHEMBL9360293

SCHEMBL9360293

O=Cc1nc(CSc2ccc3cc(O)c(O)cc3c2)cs1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.33
ATM Q13315 1/20 0.33
MAPT P10636 2/20 0.32
RAB9A P51151 2/20 0.32
NPC1 O15118 1/20 0.32
LMNA P02545 1/20 0.32
HPGD P15428 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
PRNP P04156 1/20 0.31

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
SCHEMBL9360286 0.80 KMT2A (0.39) KMT2AMEN1ALDH1A1ATMMAPT
SCHEMBL9364587 0.73 ALDH1A1 (0.32) ALDH1A1MAPTHPGDSMN1; SMN2
SCHEMBL9360309 0.69 DAO (0.35) ALDH1A1MAPTLMNA
SCHEMBL9360323 0.68 DAO (0.56) ALDH1A1MAPTRAB9ANPC1LMNA
SCHEMBL9360635 0.68 BRD4 (0.38) KMT2AMEN1ALDH1A1RAB9ANPC1
SCHEMBL9360229 0.67 DAO (0.54) RAB9ALMNA
SCHEMBL19718385 0.66
SCHEMBL9360281 0.66 ALDH1A1 (0.48) ALDH1A1RAB9ANPC1HPGDSMN1; SMN2
SCHEMBL9364582 0.65 KMT2A (0.35) KMT2AALDH1A1MAPTHPGD
SCHEMBL9360179 0.64 MAOA (0.51) ALDH1A1MAPTRAB9ANPC1SMN1; SMN2

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-0419676-B1 THIONAPHTHALENE DERIVATIVES, METHOD OF PRODUCING THE SAME, AND ANTIALLERGIC AGENT CONTAINING THE SAME TEIJIN LTD (JP) 1994-12-07 EP disclosed
EP-0419676-A1 THIONAPHTHALENE DERIVATIVES, METHOD OF PRODUCING THE SAME, AND ANTIALLERGIC AGENT CONTAINING THE SAME TEIJIN LIMITED (JP) 1991-04-03 EP disclosed