SCHEMBL11490287

SCHEMBL11490287

COC(=O)C=CCNC(C(N)=O)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.42
KMT2A Q03164 4/20 0.42
MEN1 O00255 1/20 0.42
ATM Q13315 1/20 0.40
SYK P43405 2/20 0.39
CASR P41180 1/20 0.39
POLB P06746 1/20 0.39
RAB9A P51151 1/20 0.39
KLK7 P49862 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
GPR88 Q9GZN0 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
PDGFRA P16234 1/20 0.38
MAPK1 P28482 1/20 0.38
MAPKAPK2 P49137 1/20 0.38
RPS6KA1 Q15418 1/20 0.38
AURKB Q96GD4 1/20 0.38
CSNK1G1 Q9HCP0 1/20 0.38

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
SCHEMBL11490284 0.87 KMT2A (0.41) KMT2AMEN1ATMCASRPOLB
SCHEMBL7403326 0.82 APAF1 (0.50) KMT2AMEN1CASRPOLBRAB9A
SCHEMBL11491237 0.79 CA12 (0.45) KMT2AMEN1ATMRAB9ACYP2C9
SCHEMBL24495090 0.74 MTNR1A (0.50) CYP3A4
Hydrochloric Acid SCHEMBL4196020 0.73 SMN1; SMN2 (0.43) EPHX1KMT2AMEN1POLBSMN1; SMN2
SCHEMBL10332377 0.73 EPHX1 (0.46) EPHX1SMN1; SMN2CYP3A4CYP2C9PDGFRA
SCHEMBL8307199 0.72 TSHR (0.43) KMT2AATMSYKPOLBSMN1; SMN2
SCHEMBL17445799 0.72 POLB (0.41) KMT2AMEN1POLBGPR88
SCHEMBL17291665 0.71 KMT2A (0.55) KMT2AMEN1ATMRAB9AKLK7
SCHEMBL17305914 0.71 KMT2A (0.55) KMT2AMEN1ATMRAB9AKLK7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0019401-A1 Process for preparing enamine derivatives, compounds so produced and process for preparing a 3-hydroxy-cephalosporin Lilly Industries Limited (GB) 1980-11-26 EP disclosed