SCHEMBL20795336

SCHEMBL20795336

COCc1cccc(C(=O)c2cccc(COC)c2)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MRGPRX4 Q96LA9 8/20 0.51
▸ SMN1; SMN2 Q16637 3/20 0.51
▸ RAB9A P51151 2/20 0.51
▸ TP53 P04637 2/20 0.51
▸ PKM P14618 2/20 0.51
▸ NFKB1 P19838 2/20 0.51
▸ NFKB2 Q00653 2/20 0.51
▸ RELA Q04206 2/20 0.51
▸ RXFP1 Q9HBX9 1/20 0.51
▸ LOXL2 Q9Y4K0 1/20 0.50
▸ CYP4F2 P78329 1/20 0.49
▸ CYP4A11 Q02928 1/20 0.49
▸ KDM4E B2RXH2 1/20 0.48
▸ NPC1 O15118 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ LMNA P02545 1/20 0.48
▸ ATM Q13315 1/20 0.47
▸ TDP1 Q9NUW8 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ SRD5A2 P31213 1/20 0.46

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
SCHEMBL22681476 0.95 ATM (0.57) MRGPRX4SMN1; SMN2RAB9ATP53PKM
SCHEMBL565902 0.87 MRGPRX4 (0.67) MRGPRX4SMN1; SMN2RAB9ATP53PKM
SCHEMBL3149977 0.87 MAOB (0.57) MRGPRX4SMN1; SMN2RAB9ATP53PKM
SCHEMBL30628893 0.87 MRGPRX4 (0.67) MRGPRX4SMN1; SMN2RAB9ATP53PKM
SCHEMBL31276343 0.85 LOXL2 (0.70) MRGPRX4SMN1; SMN2RAB9ALOXL2CYP4F2
SCHEMBL1544193 0.85 LOXL2 (0.70) MRGPRX4SMN1; SMN2RAB9ALOXL2CYP4F2
SCHEMBL2133327 0.85 MRGPRX4 (0.49) MRGPRX4SMN1; SMN2RAB9ATP53PKM
SCHEMBL2824632 0.85 PARP1 (0.56) MRGPRX4SMN1; SMN2RAB9ATP53PKM
SCHEMBL11634078 0.84 CYP4F2 (0.49) MRGPRX4SMN1; SMN2RAB9ATP53PKM
SCHEMBL27905651 0.84 MRGPRX4 (0.54) MRGPRX4SMN1; SMN2RAB9ATP53PKM

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-20190148756-A1 METHOD FOR PRODUCING POLYMER ELECTROLYTE MOLDED ARTICLE, POLYMER ELECTROLYTE MATERIAL, POLYMER ELECTROLYTE MEMBRANE, AND POLYMER ELECTROLYTE FUEL CELL TORAY INDUSTRIES, INC. (JP) 2019-05-16 — — US disclosed
US-10224562-B2 Method for producing polymer electrolyte molded article, polymer electrolyte material, polymer electrolyte membrane, and polymer electrolyte fuel cell TORAY INDUSTRIES, INC. (JP) 2019-03-05 — — US disclosed
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