SCHEMBL9560099

SCHEMBL9560099

C=CCON=C(C)c1cccc(N)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.48
RAB9A P51151 3/20 0.48
KMT2A Q03164 3/20 0.48
GAA P10253 3/20 0.48
SMN1; SMN2 Q16637 4/20 0.43
LMNA P02545 4/20 0.42
HTT P42858 2/20 0.42
MAPK1 P28482 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
MAPT P10636 6/20 0.41
ALDH1A1 P00352 5/20 0.41
KDM4E B2RXH2 3/20 0.40
NPC1 O15118 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
ALPG P10696 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
GFER P55789 1/20 0.40

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
SCHEMBL9560101 0.81 MEN1 (0.47) MEN1RAB9AKMT2AGAASMN1; SMN2
SCHEMBL16202013 0.76 SMN1; SMN2 (0.48) SMN1; SMN2LMNAHTTMAPK1L3MBTL1
SCHEMBL15851190 0.73 SMN1; SMN2 (0.46) MEN1RAB9AKMT2AGAASMN1; SMN2
SCHEMBL17218743 0.73 SMN1; SMN2 (0.46) MEN1RAB9AKMT2AGAASMN1; SMN2
SCHEMBL16202061 0.73 SMN1; SMN2 (0.54) RAB9AGAASMN1; SMN2LMNAHTT
SCHEMBL8062061 0.72 SMN1; SMN2 (0.43) SMN1; SMN2LMNAHTTMAPK1L3MBTL1
SCHEMBL6275322 0.72 SMN1; SMN2 (0.46) RAB9AGAASMN1; SMN2LMNAHTT
SCHEMBL13215225 0.72 SMN1; SMN2 (0.46) RAB9AGAASMN1; SMN2LMNAHTT
SCHEMBL5197529 0.72 SMN1; SMN2 (0.50) RAB9AGAASMN1; SMN2LMNAHTT
SCHEMBL6269349 0.72 SMN1; SMN2 (0.53) MEN1RAB9AKMT2AGAASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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