SCHEMBL9707490

SCHEMBL9707490

CC(=O)N(O)Cc1ccc(C(=O)Nc2ccccc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 1/20 0.57
▸ PTPN1 P18031 2/20 0.54
▸ CACNA1B Q00975 1/20 0.54
▸ APBA1 Q02410 1/20 0.54
▸ KMT2A Q03164 6/20 0.54
▸ MEN1 O00255 5/20 0.54
▸ NPC1 O15118 2/20 0.54
▸ RAB9A P51151 2/20 0.54
▸ RXFP1 Q9HBX9 1/20 0.54
▸ HDAC6 Q9UBN7 2/20 0.53
▸ HDAC2 Q92769 1/20 0.53
▸ HDAC8 Q9BY41 1/20 0.53
▸ ALOX5 P09917 1/20 0.52
▸ PTGS1 P23219 1/20 0.52
▸ PTGS2 P35354 1/20 0.52
▸ CASP3 P42574 1/20 0.51
▸ SENP7 Q9BQF6 1/20 0.51
▸ POLB P06746 2/20 0.50
▸ NR1H4 Q96RI1 1/20 0.50
▸ HDAC1 Q13547 1/20 0.50

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
SCHEMBL19197479 0.83 TRPV1 (0.61) TRPV1PTPN1CACNA1BAPBA1KMT2A
SCHEMBL1436622 0.79 ALOX5 (0.70) KMT2AMEN1NPC1RAB9AALOX5
SCHEMBL10162575 0.78 TRPV1 (0.71) TRPV1PTPN1CACNA1BAPBA1KMT2A
SCHEMBL28333561 0.77 TRPV1 (0.70) TRPV1PTPN1CACNA1BAPBA1KMT2A
SCHEMBL1315526 0.77 PTPN1 (0.87) PTPN1CACNA1BAPBA1KMT2AMEN1
SCHEMBL2642122 0.76 PTPN1 (0.67) TRPV1PTPN1CACNA1BAPBA1KMT2A
SCHEMBL9707312 0.76 PTGS1 (0.62) ALOX5PTGS1PTGS2
SCHEMBL2642119 0.76 PTPN1 (0.67) TRPV1PTPN1CACNA1BAPBA1KMT2A
SCHEMBL1128154 0.76 KMT2A (0.78) PTPN1CACNA1BAPBA1KMT2AMEN1
SCHEMBL17366600 0.76 PTPN1 (0.71) TRPV1PTPN1CACNA1BAPBA1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0196184-B1 ARYL DERIVATIVES THE WELLCOME FOUNDATION LIMITED (GB) 1992-09-16 — — EP disclosed
US-5036157-A Hydroxamic acid derivatives, lipoxygenase and cyclooxygenase inhibitors, anticoagulants, antiinflammatory agents BURROUGHS WELLCOME CO. 1991-07-30 — — US disclosed
US-4977188-A Hydroamic acid derivatives BURROUGHS WELLCOME CO. (US) 1990-12-11 — — US disclosed
WO-1990001929-A1 NEW MEDICAL USE THE WELLCOME FOUNDATION LIMITED (GB) 1990-03-08 — — WO disclosed
US-4738986-A CYCLOOXYGENASE, LIDOXYGENASE INHIBITORS BURROUGHS WELLCOME CO. (US) 1988-04-19 — — US disclosed
EP-0196184-A2 Aryl derivatives THE WELLCOME FOUNDATION LIMITED (GB) 1986-10-01 — — EP disclosed
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