SCHEMBL10486989

SCHEMBL10486989

C=C(c1ccccc1)c1ccc(OC(=O)CC)cc1

nearest known ligand 0.76

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 5/20 0.76
▸ KMT2A Q03164 7/20 0.62
▸ ESR1 P03372 3/20 0.62
▸ SMN1; SMN2 Q16637 3/20 0.62
▸ HIF1A Q16665 2/20 0.62
▸ RECQL P46063 1/20 0.62
▸ MAPT P10636 3/20 0.54
▸ HTT P42858 2/20 0.54
▸ MEN1 O00255 2/20 0.54
▸ RAB9A P51151 3/20 0.47
▸ LMNA P02545 1/20 0.47
▸ NPC1 O15118 2/20 0.46
▸ NFKB1 P19838 1/20 0.46
▸ NFKB2 Q00653 1/20 0.46
▸ RELA Q04206 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ TP53 P04637 1/20 0.45
▸ GAA P10253 1/20 0.44

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
SCHEMBL10424760 0.86 ELANE (1.00) ELANEKMT2AESR1SMN1; SMN2HIF1A
SCHEMBL27810901 0.83 ELANE (0.75) ELANEKMT2AESR1SMN1; SMN2HIF1A
SCHEMBL45119 0.82 ELANE (0.72) ELANEKMT2AESR1SMN1; SMN2HIF1A
Benzene SCHEMBL28089483 0.82 ELANE (0.72) ELANEKMT2AESR1SMN1; SMN2HIF1A
SCHEMBL9799566 0.82 ELANE (0.72) ELANEKMT2AESR1SMN1; SMN2HIF1A
SCHEMBL10414510 0.81 KMT2A (0.68) ELANEKMT2AESR1SMN1; SMN2HIF1A
SCHEMBL717516 0.81 ELANE (0.76) ELANEKMT2AESR1SMN1; SMN2MAPT
SCHEMBL5690655 0.80 KMT2A (0.72) ELANEKMT2AESR1SMN1; SMN2HIF1A
SCHEMBL8467278 0.80 ELANE (0.70) ELANEKMT2AESR1SMN1; SMN2HIF1A
Ammonia Solution, Strong SCHEMBL22042017 0.80 ELANE (0.70) ELANEKMT2AESR1SMN1; SMN2HIF1A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-1013052-A — — None — — JP disclosed
JP-1013052-A — — None — — JP disclosed
JP-S6413052-A PRODUCTION OF ((1-PHENYLETHENYL) PHENYL) PROPIONIC ACID AND/OR ITS ESTER NIPPON PETROCHEMICALS CO LTD 1989-01-17 — — JP disclosed
JP-S6413052-A PRODUCTION OF ((1-PHENYLETHENYL) PHENYL) PROPIONIC ACID AND/OR ITS ESTER NIPPON PETROCHEMICALS CO LTD 1989-01-17 — — JP disclosed
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