SCHEMBL10513547

SCHEMBL10513547

CN(C)CCNc1nc2ccc(Cl)cc2c2nc3ccccc3n12

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MAT2A P31153 1/20 0.48
▸ FLT3 P36888 6/20 0.48
▸ KDM4E B2RXH2 4/20 0.44
▸ HSP90AA1 P07900 1/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ MCL1 Q07820 1/20 0.44
▸ KMT2A Q03164 3/20 0.44
▸ ALDH1A1 P00352 2/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ POLB P06746 2/20 0.44
▸ TSHR P16473 1/20 0.44
▸ CASP1 P29466 1/20 0.44
▸ CASP7 P55210 1/20 0.44
▸ NCF1 P14598 2/20 0.43
▸ RXFP1 Q9HBX9 1/20 0.42
▸ HPGD P15428 1/20 0.42

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
SCHEMBL10512619 0.91 MAT2A (0.48) MAT2AFLT3KDM4EHSP90AA1MAPK1
SCHEMBL10511601 0.88 POLB (0.47) KDM4EHSP90AA1MAPK1MCL1KMT2A
SCHEMBL10513493 0.87 KDM4E (0.52) KDM4EHSP90AA1MAPK1MCL1KMT2A
SCHEMBL10513759 0.81 MAPT (0.51) MAT2AFLT3KDM4EKMT2AALDH1A1
SCHEMBL10514017 0.72 HPGD (0.47) KDM4EKMT2AALDH1A1MEN1POLB
SCHEMBL10510883 0.72 KDM4E (0.51) MAT2AKDM4EKMT2AALDH1A1MEN1
SCHEMBL21208568 0.71 IKBKB (0.47) MAT2AKDM4EHSP90AA1MAPK1MCL1
SCHEMBL28064513 0.70 HDAC1 (0.65) MAT2AKDM4EKMT2AALDH1A1MEN1
SCHEMBL21208490 0.68 KMT2A (0.48) KDM4EHSP90AA1MAPK1MCL1KMT2A
SCHEMBL20821410 0.67 KDM4E (0.55) KDM4EKMT2AALDH1A1MEN1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0331093-A1 Benzimidazo[1,2-c]quinazolines, their preparation and use KNOLL AG (DE) 1989-09-06 — — EP disclosed
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