SCHEMBL11788972

SCHEMBL11788972

O=C(Nc1ccc(NC(=O)c2ccccc2O)c(C(=O)O)c1)c1ccccc1O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 5/20 0.64
▸ KMT2A Q03164 4/20 0.63
▸ MEN1 O00255 3/20 0.63
▸ TP53 P04637 3/20 0.63
▸ HTT P42858 3/20 0.63
▸ HSD17B10 Q99714 2/20 0.63
▸ KDM4E B2RXH2 2/20 0.63
▸ HPGD P15428 1/20 0.63
▸ NPC1 O15118 3/20 0.61
▸ RAB9A P51151 2/20 0.61
▸ POLB P06746 1/20 0.60
▸ ALOX15 P16050 3/20 0.58
▸ GAA P10253 1/20 0.58
▸ NFKB1 P19838 1/20 0.56
▸ NFKB2 Q00653 1/20 0.56
▸ RELA Q04206 1/20 0.56
▸ SMN1; SMN2 Q16637 1/20 0.56
▸ PNLIP P16233 2/20 0.56
▸ FADS1 O60427 1/20 0.56
▸ P2RX1 P51575 1/20 0.56

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
SCHEMBL10763914 0.89 KMT2A (0.69) LMNAKMT2AMEN1TP53HTT
SCHEMBL10615518 0.88 LMNA (0.63) LMNAKMT2AMEN1TP53HTT
SCHEMBL29375984 0.88 LMNA (0.63) LMNAKMT2AMEN1TP53HTT
SCHEMBL6093462 0.88 GFER (0.69) LMNAKMT2AMEN1TP53HTT
SCHEMBL2133475 0.84 KMT2A (0.74) LMNAKMT2AMEN1TP53HTT
SCHEMBL11792714 0.84 LMNA (0.59) LMNAKMT2AMEN1TP53HTT
SCHEMBL4669122 0.84 LMNA (0.76) LMNAKMT2AMEN1TP53HTT
SCHEMBL11405554 0.84 LMNA (0.76) LMNAKMT2AMEN1TP53HTT
SCHEMBL14075282 0.82 ALOX15 (0.66) LMNAKMT2AMEN1TP53HTT
SCHEMBL6093021 0.80 LMNA (0.60) LMNAKMT2AMEN1TP53HTT

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-3953496-A ANTIPYRETICS, ANTI-ALLERGIC, ANTI-INFLAMMATORY AGENTS CHUGAI SEIYAKU KABUSHIKI KAISHA (JA) 1976-04-27 — — US claimed
US-3953496-A ANTIPYRETICS, ANTI-ALLERGIC, ANTI-INFLAMMATORY AGENTS CHUGAI SEIYAKU KABUSHIKI KAISHA (JA) 1976-04-27 — — US disclosed
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