SCHEMBL11426574

SCHEMBL11426574

Cn1cc(-c2ccccc2)c(=O)c(-c2cccc(O)c2)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BAZ2B Q9UIF8 1/20 0.44
▸ BAZ2A Q9UIF9 1/20 0.44
▸ GAPDH P04406 1/20 0.43
▸ HSD17B1 P14061 5/20 0.43
▸ HSD17B2 P37059 4/20 0.42
▸ ESR2 Q92731 2/20 0.42
▸ ALOX5 P09917 1/20 0.42
▸ CYP3A4 P08684 2/20 0.41
▸ CYP2C9 P11712 2/20 0.41
▸ ESR1 P03372 1/20 0.40
▸ ESRRA P11474 1/20 0.40
▸ KDM4E B2RXH2 2/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ BRD4 O60885 1/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ MAOA P21397 1/20 0.40

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
SCHEMBL11441378 0.85 BRD4 (0.43) KDM4EALDH1A1BRD4NPC1RAB9A
SCHEMBL11441314 0.84 BRD4 (0.52) KDM4EALDH1A1BRD4SMN1; SMN2MAPT
SCHEMBL11434522 0.82 CNR2 (0.43) ALDH1A1BRD4NPC1RAB9ASMN1; SMN2
SCHEMBL11550329 0.81 KMO (0.53) KDM4EALDH1A1AKR1C3AKR1C2
SCHEMBL11547644 0.81 BRD4 (0.48) KDM4EALDH1A1BRD4NPC1RAB9A
SCHEMBL11434332 0.81 BRD4 (0.40) BRD4HSD17B10
SCHEMBL11178194 0.81 BRD4 (0.40) ALDH1A1BRD4NPC1RAB9ASMN1; SMN2
SCHEMBL11429420 0.81 GAA (0.49) KDM4EALDH1A1BRD4NPC1RAB9A
SCHEMBL11440224 0.81 HSD17B10 (0.41) KDM4EBRD4SMN1; SMN2NPSR1MAOB
SCHEMBL11434380 0.79 BAZ2B (0.36) BAZ2BBAZ2ABRD4HSD17B10

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-4235619-A USING 3-PHENYL-4(1H)-PYRIDONES OR PYRIDINETHIONES ELI LILLY AND COMPANY (US) 1980-11-25 — — US disclosed
US-4152136-A HERBICIDES ELI LILLY AND COMPANY (US) 1979-05-01 — — US disclosed
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