SCHEMBL17744786

SCHEMBL17744786

Nc1ccc(C(=O)Oc2cccc(OC(=O)c3cccc(N)c3)c2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR1H4 Q96RI1 1/20 0.50
▸ PRSS1 P07477 4/20 0.49
▸ ACR P10323 2/20 0.49
▸ KMT2A Q03164 6/20 0.48
▸ F2 P00734 2/20 0.48
▸ PRSS2 P07478 2/20 0.48
▸ PRSS3 P35030 2/20 0.48
▸ ESR1 P03372 2/20 0.48
▸ ESR2 Q92731 2/20 0.48
▸ PKM P14618 1/20 0.48
▸ MEN1 O00255 2/20 0.46
▸ MAPT P10636 2/20 0.46
▸ PARP10 Q53GL7 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46
▸ PBRM1 Q86U86 1/20 0.46
▸ LMNA P02545 2/20 0.45
▸ TP53 P04637 1/20 0.45
▸ CYP3A4 P08684 1/20 0.45
▸ ADORA3 P0DMS8 1/20 0.45
▸ CHRM1 P11229 1/20 0.45

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
SCHEMBL30164695 0.93 ESR1 (0.53) PRSS1ACRKMT2AESR1ESR2
SCHEMBL5437080 0.93 ESR1 (0.53) PRSS1ACRKMT2AESR1ESR2
SCHEMBL17744879 0.92 PRSS1 (0.56) NR1H4PRSS1ACRKMT2AF2
SCHEMBL9185619 0.92 NR1H4 (0.54) NR1H4PRSS1ACRKMT2AF2
SCHEMBL107413 0.92 NR1H4 (0.56) NR1H4PRSS1ACRKMT2AF2
SCHEMBL30957000 0.91 PRSS1 (0.52) NR1H4PRSS1ACRKMT2AF2
SCHEMBL31601071 0.90 ESR1 (0.53) PRSS1ACRKMT2AESR1ESR2
SCHEMBL9188677 0.90 ESR1 (0.53) PRSS1ACRKMT2AESR1ESR2
SCHEMBL22826274 0.89 PRSS1 (0.56) NR1H4PRSS1ACRKMT2AF2
SCHEMBL29846109 0.88 KMT2A (0.51) NR1H4PRSS1KMT2AF2PRSS2

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
US-10400076-B2 Epoxy resin composition, prepreg, and carbon fiber-reinforced composite material TORAY INDUSTRIES, INC. (JP) 2019-09-03 — — US disclosed
EP-3020763-B1 EPOXY RESIN COMPOSITION, PREPREG, AND CARBON FIBER-REINFORCED COMPOSITE MATERIAL TORAY INDUSTRIES (JP) 2018-08-29 — — EP disclosed
US-20160152785-A1 EPOXY RESIN COMPOSITION, PREPREG, AND CARBON FIBER-REINFORCED COMPOSITE MATERIAL TORAY INDUSTRIES, INC. (JP) 2016-06-02 — — US disclosed
EP-3020763-A1 EPOXY RESIN COMPOSITION, PREPREG, AND CARBON FIBER-REINFORCED COMPOSITE MATERIAL Toray Industries, Inc. (JP) 2016-05-18 — — EP disclosed
Send feedback