SCHEMBL9696100

SCHEMBL9696100

COc1c[nH]c(-c2ccccc2)nc1=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.50
TNKS O95271 2/20 0.48
TNKS2 Q9H2K2 2/20 0.48
PARP2 Q9UGN5 1/20 0.48
PDGFRB P09619 2/20 0.45
HTT P42858 2/20 0.43
PDE3B Q13370 1/20 0.41
PDE3A Q14432 1/20 0.41
ADORA3 P0DMS8 2/20 0.40
ADORA2A P29274 2/20 0.40
HPGD P15428 2/20 0.40
ADORA1 P30542 1/20 0.40
PGR P06401 1/20 0.40
POLB P06746 1/20 0.40
GUSB P08236 2/20 0.40
PDGFRA P16234 1/20 0.40
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
MAPT P10636 2/20 0.39
KDM4E B2RXH2 2/20 0.39

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
SCHEMBL7517964 0.75 ALDH1A1 (0.42) RECQLTNKSTNKS2PARP2PDGFRB
SCHEMBL9696096 0.74 BTK (0.40) TNKSTNKS2HPGDPOLBNPC1
SCHEMBL4147456 0.74 MAPT (0.46) TNKSTNKS2ADORA2AHPGDADORA1
SCHEMBL17280154 0.73 PDGFRB (0.45) RECQLPDGFRBHTTHPGDPDGFRA
SCHEMBL1660430 0.73 KDM4E (0.60) PDGFRBHTTADORA2AHPGDGUSB
SCHEMBL1683758 0.72 CNR2 (0.52) TNKSTNKS2PARP2ADORA3ADORA2A
SCHEMBL4423277 0.71 TUBB4A (0.49) PDGFRBHPGDMAPTKDM4EMEN1
SCHEMBL24392021 0.71 PDE3B (0.63) RECQLTNKSTNKS2PARP2HTT
SCHEMBL29588668 0.71 PDE3B (0.63) RECQLTNKSTNKS2PARP2HTT
SCHEMBL15775406 0.71 TNKS (0.63) RECQLTNKSTNKS2PARP2HTT

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
WO-1992005159-A1 2-PHENYL-PYRIMIDINES, PROCESS FOR PRODUCING THE SAME, AGENTS CONTAINING THE SAME AND THEIR USE AS FUNGICIDES HOECHST AKTIENGESELLSCHAFT (DE) 1992-04-02 WO disclosed