SCHEMBL8545658

SCHEMBL8545658

O=C(Cl)c1cccn1N1C(=O)c2ccccc2C1=O

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.44
KMT2A Q03164 2/20 0.40
CASP3 P42574 2/20 0.39
CA12 O43570 2/20 0.37
CA9 Q16790 2/20 0.37
GRM1 Q13255 1/20 0.35
CES1 P23141 3/20 0.34
TTR P02766 1/20 0.34
SCN2A Q99250 2/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
ELANE P08246 1/20 0.34
BCL2 P10415 1/20 0.33
MCL1 Q07820 1/20 0.33
MEN1 O00255 1/20 0.33

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
SCHEMBL8305666 0.83 POLB (0.48) POLBKMT2ACASP3CA12CA9
SCHEMBL8446968 0.80 ALDH1A1 (0.47) POLBKMT2ACA12CA9SCN2A
SCHEMBL10365839 0.80 CNR2 (0.44) POLBKMT2AGRM1CES1MEN1
SCHEMBL8539713 0.79 POLB (0.41) POLBKMT2ACASP3CA12CA9
SCHEMBL8540702 0.79 KEAP1 (0.42) POLBKMT2ACASP3CA12CA9
SCHEMBL8543267 0.79 CES1 (0.42) POLBKMT2ACASP3CA12CA9
SCHEMBL8303714 0.79 LMNA (0.43) POLBKMT2ACASP3
SCHEMBL1966590 0.79 POLB (0.45) POLBKMT2ASCN2A
SCHEMBL8545476 0.78 SLC18A3 (0.40) POLBKMT2ACASP3CES1
SCHEMBL8544645 0.77 POLB (0.37) POLBKMT2ACASP3CA12CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0648764-B1 N-(substituted amino)pyrrole derivatives, preparation process thereof, and herbicidal compositions KUREHA CHEMICAL IND CO LTD (JP) 1998-12-16 EP disclosed
US-5612287-A N-(substituted amino) pyrrole derivatives preparation process thereof, and herbicidal compositions KUREHA KAGAKU KOGYO K.K. (JP) 1997-03-18 US disclosed
US-5604178-A N-(substituted amino)pyrrole derivatives, and herbicidal compositions KUREHA KAGAKU KOGYO K.K. (JP) 1997-02-18 US disclosed
EP-0648764-A1 N-(substituted amino)pyrrole derivatives, preparation process thereof, and herbicidal compositions KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1995-04-19 EP disclosed