SCHEMBL9987983

SCHEMBL9987983

CCNC(=O)Oc1cc2cccnc2n1-c1cccc(F)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 7/20 0.48
PDE4D Q08499 3/20 0.48
MET P08581 5/20 0.46
PDGFRB P09619 1/20 0.43
KIT P10721 1/20 0.43
PDGFRA P16234 1/20 0.43
FLT4 P35916 1/20 0.43
KDR P35968 1/20 0.43
FLT3 P36888 1/20 0.43
ALK Q9UM73 1/20 0.43
RXFP1 Q9HBX9 1/20 0.43
HPGD P15428 2/20 0.42
TRPV1 Q8NER1 1/20 0.40
TP53 P04637 2/20 0.40
AHR P35869 1/20 0.40
NPC1 O15118 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
RAB9A P51151 1/20 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
SCHEMBL9987772 0.74 PDE4B (0.49) PDE4BPDE4DTRPV1
SCHEMBL9987982 0.71 PDE4B (0.46) PDE4BPDE4DNPC1ALDH1A1LMNA
SCHEMBL10674017 0.70 KMT2A (0.49) PDE4BPDE4DMETTRPV1AHR
SCHEMBL9986954 0.70 TRPV1 (0.50) PDE4BPDE4DTRPV1
SCHEMBL12035283 0.70 PIK3CG (0.42) PDE4BPDE4DALDH1A1LMNASMN1; SMN2
SCHEMBL9987445 0.69 REN (0.40) HPGDTP53ALDH1A1LMNAMAPT
SCHEMBL7606599 0.67 NPC1 (0.45) NPC1RAB9A
SCHEMBL9987354 0.67 REN (0.38) HPGDTP53LMNAMAPT
SCHEMBL9986022 0.67 KMT2A (0.42) PDE4BPDE4DTRPV1AHRNPC1
SCHEMBL9986633 0.66 PDE4B (0.41) PDE4BPDE4DTRPV1AHRNPC1

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-2011163195-A1 FUSED PYRROLE DERIVATIVES AS PI3K INHIBITORS INCYTE CORPORATION (US) 2011-12-29 WO disclosed