SCHEMBL9877319

SCHEMBL9877319

CN(O)C(=O)c1cccc(NC(=O)c2ccccc2)c1

nearest known ligand 0.67

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KCNK3 O14649 7/20 0.67
KCNK9 Q9NPC2 7/20 0.67
RAB9A P51151 5/20 0.63
KMT2A Q03164 4/20 0.60
MEN1 O00255 3/20 0.60
POLB P06746 2/20 0.60
SIRT1 Q96EB6 1/20 0.59
NPC1 O15118 4/20 0.58
MAPT P10636 1/20 0.58
HTT P42858 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
HPGD P15428 1/20 0.58
NLRP3 Q96P20 1/20 0.57
TP53 P04637 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
SCHEMBL9877204 0.84 CACNA1B (0.65) RAB9AKMT2AMEN1POLBSIRT1
SCHEMBL7500312 0.82 KMT2A (0.84) KCNK3KCNK9RAB9AKMT2AMEN1
SCHEMBL2298254 0.81 KCNK3 (1.00) KCNK3KCNK9RAB9AKMT2AMEN1
SCHEMBL679144 0.80 KMT2A (0.90) KCNK3KCNK9RAB9AKMT2AMEN1
SCHEMBL7745692 0.79 KCNK3 (0.80) KCNK3KCNK9RAB9AKMT2AMEN1
Hydrochloric Acid SCHEMBL2106175 0.78 KMT2A (0.87) KCNK3KCNK9RAB9AKMT2AMEN1
SCHEMBL7745302 0.78 KCNK3 (0.79) KCNK3KCNK9RAB9AKMT2AMEN1
SCHEMBL14715827 0.78 KCNK3 (0.92) KCNK3KCNK9RAB9AKMT2AMEN1
SCHEMBL14715912 0.78 KCNK3 (0.92) KCNK3KCNK9RAB9AKMT2AMEN1
SCHEMBL9877862 0.78 HDAC8 (0.53) KMT2AMEN1

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