SCHEMBL11813383

SCHEMBL11813383

COc1ccc2c(c1OC)C(=O)N(NC(=O)c1ccccc1O)C2=O

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PTGS1 P23219 1/20 0.60
▸ PTGS2 P35354 1/20 0.60
▸ ALDH1A1 P00352 5/20 0.49
▸ POLB P06746 3/20 0.49
▸ KDM4E B2RXH2 3/20 0.46
▸ HSD17B10 Q99714 2/20 0.46
▸ MEN1 O00255 7/20 0.46
▸ KMT2A Q03164 7/20 0.46
▸ GAA P10253 2/20 0.46
▸ ATM Q13315 2/20 0.46
▸ RAB9A P51151 3/20 0.43
▸ NPC1 O15118 2/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ MAPT P10636 2/20 0.42
▸ USP2 O75604 1/20 0.42
▸ HPGD P15428 1/20 0.42
▸ CYP3A4 P08684 1/20 0.41
▸ KCNMA1 Q12791 1/20 0.40
▸ BLM P54132 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
SCHEMBL11806443 0.89 PTGS1 (0.61) PTGS1PTGS2ALDH1A1POLBKDM4E
SCHEMBL11811601 0.86 PTGS1 (0.62) PTGS1PTGS2ALDH1A1POLBKDM4E
SCHEMBL11817513 0.86 PTGS1 (0.67) PTGS1PTGS2ALDH1A1POLBKDM4E
SCHEMBL11812310 0.85 PTGS1 (0.56) PTGS1PTGS2ALDH1A1POLBKDM4E
SCHEMBL11808261 0.83 PTGS1 (0.69) PTGS1PTGS2ALDH1A1POLBKDM4E
SCHEMBL11807179 0.78 PTGS1 (0.66) PTGS1PTGS2ALDH1A1KDM4EHSD17B10
SCHEMBL11805289 0.78 PTGS1 (0.54) PTGS1PTGS2ALDH1A1POLBKDM4E
SCHEMBL11811568 0.78 PTGS1 (0.54) PTGS1PTGS2ALDH1A1POLBKDM4E
SCHEMBL11808813 0.78 PTGS1 (0.61) PTGS1PTGS2ALDH1A1POLBKDM4E
SCHEMBL11807255 0.78 PTGS1 (0.54) PTGS1PTGS2ALDH1A1POLBKDM4E

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-3956331-A STABILIZER FOR POLYOLEFIN UBE INDUSTRIES, LTD. (JA) 1976-05-11 — — US disclosed
US-3933736-A HOMO- AND CO-POLYMERS OF ETHYLENE, PROPYLENE, BUTENE-1, PENTENE-1, AND 4-METHYLPENTENE-1 WITH ETHYL ACRYLATE OR VINYL ACETATE UBE INDUSTRIES, LTD. (JA) 1976-01-20 — — US disclosed
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