SCHEMBL10511601

SCHEMBL10511601

Cc1ccc2nc(NCCN(C)C)n3c4ccccc4nc3c2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 3/20 0.47
▸ RAD52 P43351 3/20 0.47
▸ SMARCA2 P51531 1/20 0.47
▸ KDM4E B2RXH2 6/20 0.47
▸ HSP90AA1 P07900 2/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ MCL1 Q07820 1/20 0.47
▸ KMT2A Q03164 5/20 0.47
▸ MEN1 O00255 3/20 0.47
▸ ALDH1A1 P00352 2/20 0.47
▸ NCF1 P14598 2/20 0.46
▸ RXFP1 Q9HBX9 2/20 0.45
▸ CASP1 P29466 2/20 0.45
▸ CASP7 P55210 2/20 0.45
▸ TSHR P16473 1/20 0.45
▸ LMNA P02545 2/20 0.44
▸ HTT P42858 1/20 0.44
▸ MAPT P10636 2/20 0.43
▸ TP53 P04637 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.43

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
SCHEMBL10513493 0.88 KDM4E (0.52) POLBRAD52SMARCA2KDM4EHSP90AA1
SCHEMBL10513547 0.88 MAT2A (0.48) POLBKDM4EHSP90AA1MAPK1MCL1
SCHEMBL10512619 0.81 MAT2A (0.48) POLBKDM4EHSP90AA1MAPK1MCL1
SCHEMBL10512791 0.78 HPGD (0.54) POLBKDM4EKMT2AMEN1ALDH1A1
SCHEMBL10513726 0.73 KDM4E (0.54) POLBKDM4EKMT2AMEN1ALDH1A1
SCHEMBL12072917 0.71 ALDH1A1 (0.55) POLBKDM4EKMT2AMEN1ALDH1A1
SCHEMBL21208490 0.70 KMT2A (0.48) POLBRAD52SMARCA2KDM4EHSP90AA1
SCHEMBL12072919 0.70 KDM4E (0.52) POLBKDM4EKMT2AMEN1ALDH1A1
SCHEMBL28064492 0.69 HDAC1 (0.66) POLBKDM4EKMT2AMEN1ALDH1A1
SCHEMBL10513759 0.68 MAPT (0.51) POLBKDM4EKMT2AMEN1ALDH1A1

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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