SCHEMBL4828173

SCHEMBL4828173

CNC(=O)c1nccc(N)c1C

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 1/20 0.48
CFTR P13569 1/20 0.38
PRKCI P41743 5/20 0.36
YTHDC1 Q96MU7 1/20 0.36
ATR Q13535 1/20 0.36
PIK3C3 Q8NEB9 1/20 0.35
NOS3 P29474 1/20 0.34
NOS2 P35228 1/20 0.34
PLK1 P53350 2/20 0.34
KDM4E B2RXH2 2/20 0.34
GAA P10253 2/20 0.34
P2RX7 Q99572 1/20 0.34
ALDH1A1 P00352 1/20 0.34
GLA P06280 1/20 0.34
GRM5 P41594 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL31184803 0.82 L3MBTL1 (0.46) CFTRKDM4EGAAALDH1A1GLA
SCHEMBL22207732 0.82 L3MBTL1 (0.46) CFTRKDM4EGAAALDH1A1GLA
SCHEMBL1336311 0.79 KDM4E (0.44) NOS3NOS2KDM4EALDH1A1
SCHEMBL30781521 0.79 KDM4E (0.44) NOS3NOS2KDM4EALDH1A1
SCHEMBL31408890 0.79 MAP2K3 (0.42) PRKCIATRNOS3NOS2ALDH1A1
SCHEMBL3548766 0.79 MAPT (0.38) YTHDC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL4828179 0.79 NOS3 (0.47) PTPN11CFTRPRKCIYTHDC1ATR
SCHEMBL1228642 0.76 GRM4 (0.54) PTPN11PLK1KDM4EP2RX7GRM5
SCHEMBL26672365 0.76 PLK1 (0.41) PLK1KDM4EGAAALDH1A1SMN1; SMN2
SCHEMBL5556257 0.75 GRM6 (0.40) PRKCIATRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1928843-A1 BIS-ARYL UREA COMPOUNDS FOR THE TREATMENT OF PROTEIN KINASE-MEDIATED DISEAES Amgen, Inc (US) 2008-06-11 EP claimed
WO-2007024754-A1 BIS-ARYL UREA COMPOUNDS FOR THE TREATMENT OF PROTEIN KINASE-MEDIATED DISEAES AMGEN INC. (US) 2007-03-01 WO claimed