SCHEMBL3625593

SCHEMBL3625593

Clc1cccc(-c2n[c][nH]n2)c1Cl

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.45
NOTUM Q6P988 2/20 0.41
NUDT1 P36639 2/20 0.37
CNR2 P34972 7/20 0.37
LDHA P00338 1/20 0.36
CYP2D6 P10635 1/20 0.36
MAOA P21397 1/20 0.36
MAPK1 P28482 1/20 0.36
ADRA1A P35348 1/20 0.36
SCN4A P35499 1/20 0.36
BLM P54132 1/20 0.36
PMP22 Q01453 1/20 0.36
PDE3A Q14432 1/20 0.36
SCN5A Q14524 1/20 0.36
SCN9A Q15858 1/20 0.36
SCN2A Q99250 1/20 0.36
SCN3A Q9NY46 1/20 0.36
SCN10A Q9Y5Y9 1/20 0.36
GRM5 P41594 1/20 0.34
CNR1 P21554 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
SCHEMBL1528152 0.85 LDHA (0.50) IDO1NOTUMLDHACYP2D6MAPK1
SCHEMBL4638665 0.83 PDPK1 (0.38) IDO1
SCHEMBL13113376 0.69 LDHA (0.73) IDO1LDHA
SCHEMBL6439475 0.69 CNR2 (0.50) IDO1NOTUMNUDT1CNR2CYP2D6
SCHEMBL440943 0.68 TSHR (0.52) IDO1NOTUMNUDT1CNR2CYP2D6
SCHEMBL3623272 0.68 IDO1 (0.53) IDO1NOTUMNUDT1CNR2CYP2D6
SCHEMBL6003439 0.68 IDO1 (0.49) IDO1NOTUMNUDT1CNR2CYP2D6
SCHEMBL9948027 0.67 CNR2 (0.39) IDO1NOTUMNUDT1CNR2CYP2D6
SCHEMBL970721 0.66 RPA1 (0.47) NOTUM
SCHEMBL17045019 0.66 CNR2 (0.47) IDO1NOTUMNUDT1CNR2CYP2D6

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
EP-2144898-A2 HETEROCYCLIC HYDRAZIDE COMPOUND AND PESTICIDAL USE OF THE SAME Sumitomo Chemical Company, Limited (JP) 2010-01-20 EP disclosed
WO-2008130021-A2 HETEROCYCLIC HYDRAZIDE COMPOUND AND PESTICIDAL USE OF THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-10-30 WO disclosed
EP-1937664-A1 HYDRAZIDE COMPOUND AND PESTICIDAL USE OF THE SAME Sumitomo Chemical Company, Limited (JP) 2008-07-02 EP disclosed
WO-2007043677-A9 HYDRAZIDE COMPOUND AND PESTICIDAL USE OF THE SAME SUMITOMO CHEMICAL CO (JP) 2007-06-07 WO disclosed
WO-2007043677-A1 HYDRAZIDE COMPOUND AND PESTICIDAL USE OF THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-04-19 WO disclosed