SCHEMBL8618979

SCHEMBL8618979

O=C1C=NC(c2ccc(F)cc2)=N1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 8/20 0.39
NOTUM Q6P988 1/20 0.35
RAB9A P51151 3/20 0.34
NPC1 O15118 1/20 0.34
MAPT P10636 1/20 0.34
BCL2L1 Q07817 1/20 0.33
BAD Q92934 1/20 0.33
ALDH1A1 P00352 1/20 0.33
ALOX5 P09917 1/20 0.33
USP1 O94782 1/20 0.33
USP19 O94966 1/20 0.33
UCHL3 P15374 1/20 0.33
MAPK10 P53779 1/20 0.32
ERCC1 P07992 1/20 0.32
ERCC4 Q92889 1/20 0.32
AR P10275 1/20 0.31
POLB P06746 1/20 0.31
TNKS O95271 1/20 0.31
TNKS2 Q9H2K2 1/20 0.31
PARP2 Q9UGN5 1/20 0.31

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
SCHEMBL8618924 0.79 NOTUM (0.36) NOTUMRAB9ANPC1MAPTALDH1A1
SCHEMBL643335 0.78 MAPT (0.37) NOTUMRAB9ANPC1MAPTALDH1A1
SCHEMBL8620821 0.74
SCHEMBL8618626 0.68 NOTUM (0.39) MAPK14NOTUMRAB9ANPC1MAPT
SCHEMBL10623715 0.67 CYP3A4 (0.50) RAB9ANPC1MAPTALDH1A1POLB
SCHEMBL11797429 0.67 TSHR (0.38) RAB9ANPC1MAPTALDH1A1
SCHEMBL10609471 0.67
SCHEMBL8618657 0.67 MAPK14 (0.39) MAPK14NOTUMRAB9ANPC1MAPT
SCHEMBL5887803 0.65 RAB9A (0.39) MAPK14NOTUMRAB9ANPC1ALDH1A1
SCHEMBL4634110 0.64

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5849861-A Polyquinazolines and methods for their preparation HITACHI CHEMICAL CO., LTD. (JP) 1998-12-15 US disclosed
US-5686560-A TREATING A MONOMER WITH A BASE IN A DIPOLAR SOLVENT HITACHI CHEMICAL CO., LTD. (JP) 1997-11-11 US disclosed