SCHEMBL9877476

SCHEMBL9877476

CN(O)C(=O)c1cccc(COc2ccccc2-c2ccccc2)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGER1 P34995 7/20 0.56
▸ RXRA P19793 1/20 0.55
▸ RXRB P28702 1/20 0.55
▸ RXRG P48443 1/20 0.55
▸ MRGPRX4 Q96LA9 6/20 0.53
▸ PTGER4 P35408 5/20 0.52
▸ PTGER3 P43115 5/20 0.52
▸ PTGER2 P43116 5/20 0.52
▸ SMN1; SMN2 Q16637 3/20 0.51
▸ L3MBTL1 Q9Y468 3/20 0.51
▸ NPC1 O15118 2/20 0.51
▸ HPGD P15428 2/20 0.51
▸ RAB9A P51151 2/20 0.51
▸ HTT P42858 2/20 0.51
▸ ALDH1A1 P00352 2/20 0.51
▸ MAPT P10636 1/20 0.51
▸ MDM2 Q00987 1/20 0.51
▸ GPR55 Q9Y2T6 1/20 0.51
▸ MEN1 O00255 1/20 0.50
▸ MITF O75030 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
SCHEMBL9707333 0.81 MRGPRX4 (0.70) MRGPRX4SMN1; SMN2L3MBTL1NPC1HPGD
SCHEMBL13739157 0.78 RXRA (0.59) PTGER1RXRARXRBRXRGPTGER4
SCHEMBL9526423 0.77 PTGER1 (0.72) PTGER1RXRARXRBRXRGMRGPRX4
Acetic Acid SCHEMBL5690407 0.77 RXRA (0.72) PTGER1RXRARXRBRXRGPTGER4
SCHEMBL10466517 0.77 MAOB (0.69) MEN1KMT2A
SCHEMBL9707413 0.75 MRGPRX4 (0.70) MRGPRX4SMN1; SMN2NPC1RAB9AMAPT
SCHEMBL1667780 0.74 PTGER1 (0.72) PTGER1RXRARXRBRXRGPTGER4
SCHEMBL201074 0.73 RXRA (0.70) PTGER1RXRARXRBRXRGPTGER4
SCHEMBL5096132 0.72 PTGER1 (1.00) PTGER1RXRARXRBRXRGMRGPRX4
SCHEMBL9508299 0.72 ALOX5 (0.58) L3MBTL1NPC1RAB9AMAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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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