SCHEMBL11337436

SCHEMBL11337436

O=C(c1ccccc1)c1cccc(OCc2ccc(-c3nc4ccccc4o3)cc2)c1O

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 4/20 0.48
▸ HPGD P15428 3/20 0.48
▸ HSD17B10 Q99714 3/20 0.48
▸ TP53 P04637 3/20 0.48
▸ NPC1 O15118 3/20 0.48
▸ ALDH1A1 P00352 3/20 0.48
▸ KDM4E B2RXH2 2/20 0.48
▸ MAPT P10636 5/20 0.47
▸ RAB9A P51151 2/20 0.47
▸ BCHE P06276 1/20 0.46
▸ RXFP1 Q9HBX9 1/20 0.45
▸ CEPT1 Q9Y6K0 1/20 0.45
▸ PPARG P37231 1/20 0.42
▸ DHODH Q02127 1/20 0.41
▸ ATM Q13315 1/20 0.41

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
SCHEMBL11844094 0.82 PDK1 (0.49) SMN1; SMN2HPGDHSD17B10TP53NPC1
SCHEMBL11337433 0.79 MAPT (0.43) SMN1; SMN2HPGDHSD17B10TP53NPC1
SCHEMBL4728970 0.79 ATM (0.55) SMN1; SMN2HPGDTP53NPC1MAPT
SCHEMBL11337441 0.78 THRB (0.41) SMN1; SMN2HPGDHSD17B10TP53NPC1
SCHEMBL5393391 0.77 RXRA (0.58) HPGDALDH1A1KDM4EMAPTPPARG
SCHEMBL11553318 0.72 MAPT (0.75) SMN1; SMN2HPGDHSD17B10TP53NPC1
SCHEMBL13067553 0.72 NPC1 (0.63) SMN1; SMN2HPGDHSD17B10TP53NPC1
SCHEMBL11520960 0.71 MAPT (0.52) SMN1; SMN2HPGDHSD17B10TP53NPC1
SCHEMBL11327576 0.71 MAPT (0.57) SMN1; SMN2HPGDHSD17B10TP53NPC1
SCHEMBL10849435 0.71 NPC1 (0.69) SMN1; SMN2HPGDHSD17B10TP53NPC1

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
US-4265804-A BENZOXAZOYLBENZOATES, OXADIAZOLE-2,5-DIBENZOATES, BENZOTRIAZOLES AND BENZOTRIAZOTRIAZOLES EASTMAN KODAK COMPANY (US) 1981-05-05 — — US claimed
US-4265804-A BENZOXAZOYLBENZOATES, OXADIAZOLE-2,5-DIBENZOATES, BENZOTRIAZOLES AND BENZOTRIAZOTRIAZOLES EASTMAN KODAK COMPANY (US) 1981-05-05 — — US disclosed
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