SCHEMBL9156002

SCHEMBL9156002

CC(=NO)c1cccc(N)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.57
RAB9A P51151 3/20 0.57
KMT2A Q03164 3/20 0.57
GAA P10253 2/20 0.57
F2 P00734 1/20 0.48
PLG P00747 1/20 0.48
PRSS1 P07477 1/20 0.48
PRSS2 P07478 1/20 0.48
PRSS3 P35030 1/20 0.48
MAPT P10636 4/20 0.48
ALDH1A1 P00352 3/20 0.48
PBRM1 Q86U86 1/20 0.47
FURIN P09958 1/20 0.47
NOS1 P29475 1/20 0.47
NPC1 O15118 3/20 0.47
KDM4E B2RXH2 2/20 0.47
GFER P55789 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
LMNA P02545 2/20 0.47
CYP3A4 P08684 2/20 0.47

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
SCHEMBL9155999 1.00 MEN1 (0.57) MEN1RAB9AKMT2AGAAF2
SCHEMBL4157209 0.83 MEN1 (0.57) MEN1RAB9AKMT2AGAAF2
SCHEMBL9560101 0.83 MEN1 (0.47) MEN1RAB9AKMT2AGAAF2
SCHEMBL30620493 0.77 PARP1 (0.50) MEN1RAB9AKMT2AMAPTALDH1A1
SCHEMBL2481256 0.77 F2 (0.55) MEN1RAB9AKMT2AGAAF2
SCHEMBL17730485 0.77 F2 (0.55) MEN1RAB9AKMT2AGAAF2
SCHEMBL31650872 0.77 F2 (0.55) MEN1RAB9AKMT2AGAAF2
SCHEMBL8312824 0.77 F2 (0.55) MEN1RAB9AKMT2AGAAF2
SCHEMBL8407427 0.77 PARP1 (0.50) MEN1RAB9AKMT2AMAPTALDH1A1
SCHEMBL2804304 0.77 KDM4E (0.58) RAB9AGAAMAPTALDH1A1FURIN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112574135-B 4-aryl-5-thioether-2-difluoromethyl oxazole, and derivatives and synthesis method thereof 湖南工程学院 2022-09-23 CN claimed
CN-112574135-A 4-aryl-5-thioether-2-difluoromethyl oxazole, and derivatives and synthesis method thereof 湖南工程学院 2021-03-30 CN claimed
CN-112574135-B 4-aryl-5-thioether-2-difluoromethyl oxazole, and derivatives and synthesis method thereof 湖南工程学院 2022-09-23 CN disclosed
CN-112574135-A 4-aryl-5-thioether-2-difluoromethyl oxazole, and derivatives and synthesis method thereof 湖南工程学院 2021-03-30 CN disclosed
EP-2927218-A1 TETRAZOLINONE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-10-07 EP disclosed
US-5382590-A Gastrointestinal disorders and nervous system disorders RHONE-POULENC RORER S.A. (FR) 1995-01-17 US disclosed
EP-0194554-B1 PROCESS FOR PRODUCTION OF OXIME DERIVATIVES NIPPON ZEON CO., LTD. (JP) 1993-09-01 EP disclosed
US-4906768-A Process for production of oxime derivatives NIPPON ZEON CO., LTD. (JP) 1990-03-06 US disclosed
EP-0194554-A2 Process for production of oxime derivatives NIPPON ZEON CO., LTD. (JP) 1986-09-17 EP disclosed