SCHEMBL8544645

SCHEMBL8544645

O=C(CCCCl)c1cccn1N1C(=O)c2ccccc2C1=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.37
ALDH1A1 P00352 4/20 0.35
CASP3 P42574 2/20 0.35
MAPT P10636 1/20 0.35
RAB9A P51151 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
SENP8 Q96LD8 1/20 0.35
SENP7 Q9BQF6 1/20 0.35
SENP6 Q9GZR1 1/20 0.35
CA12 O43570 1/20 0.34
CA9 Q16790 1/20 0.34
KMT2A Q03164 2/20 0.34
HDAC8 Q9BY41 3/20 0.33
HDAC3 O15379 2/20 0.33
HDAC4 P56524 2/20 0.33
HDAC1 Q13547 2/20 0.33
HDAC7 Q8WUI4 2/20 0.33
HDAC2 Q92769 2/20 0.33
HDAC10 Q969S8 2/20 0.33
HDAC11 Q96DB2 2/20 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
SCHEMBL8543267 0.80 CES1 (0.42) POLBALDH1A1CASP3MAPTRAB9A
SCHEMBL8545658 0.77 POLB (0.44) POLBCASP3CA12CA9KMT2A
SCHEMBL8305666 0.74 POLB (0.48) POLBALDH1A1CASP3CA12CA9
SCHEMBL8446968 0.72 ALDH1A1 (0.47) POLBALDH1A1MAPTNPSR1CA12
SCHEMBL10365839 0.71 CNR2 (0.44) POLBALDH1A1MAPTRAB9AKMT2A
SCHEMBL8546708 0.71 LMNA (0.33) ALDH1A1MAPTHDAC8HDAC3HDAC4
SCHEMBL8539713 0.71 POLB (0.41) POLBCASP3CA12CA9KMT2A
SCHEMBL8540702 0.71 KEAP1 (0.42) POLBALDH1A1CASP3MAPTRAB9A
SCHEMBL8303714 0.71 LMNA (0.43) POLBALDH1A1CASP3KMT2A
SCHEMBL1966590 0.71 POLB (0.45) POLBALDH1A1MAPTKMT2A

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