SCHEMBL8543267

SCHEMBL8543267

CCC(=O)c1cccn1N1C(=O)c2ccccc2C1=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 2/20 0.42
POLB P06746 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.39
KDM4E B2RXH2 1/20 0.39
HTT P42858 1/20 0.39
CA12 O43570 1/20 0.38
CA9 Q16790 1/20 0.38
KMT2A Q03164 2/20 0.37
ALDH1A1 P00352 5/20 0.37
MAPT P10636 2/20 0.37
CYP1A2 P05177 2/20 0.37
CYP2C9 P11712 2/20 0.37
NPC1 O15118 2/20 0.37
MEN1 O00255 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C19 P33261 1/20 0.37
RAB9A P51151 1/20 0.37
TP53 P04637 1/20 0.36
GLA P06280 1/20 0.36

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 0.82 POLB (0.48) CES1POLBKDM4ECA12CA9
SCHEMBL8544645 0.80 POLB (0.37) POLBCA12CA9KMT2AALDH1A1
SCHEMBL8545658 0.79 POLB (0.44) CES1POLBCA12CA9KMT2A
SCHEMBL1966590 0.78 POLB (0.45) POLBSMN1; SMN2HTTKMT2AALDH1A1
SCHEMBL8540702 0.78 KEAP1 (0.42) CES1POLBSMN1; SMN2KDM4EHTT
SCHEMBL8303714 0.78 LMNA (0.43) POLBHTTKMT2AALDH1A1NPC1
SCHEMBL8545476 0.77 SLC18A3 (0.40) CES1POLBSMN1; SMN2KMT2AALDH1A1
SCHEMBL8446968 0.76 ALDH1A1 (0.47) POLBSMN1; SMN2CA12CA9KMT2A
SCHEMBL8539713 0.75 POLB (0.41) CES1POLBHTTCA12CA9
SCHEMBL10365839 0.73 CNR2 (0.44) CES1POLBSMN1; SMN2KDM4EHTT

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