SCHEMBL1720686

SCHEMBL1720686

CCn1c(-c2ccc(OC(c3cccc(F)c3)C3CNC(=O)C3)cc2)nc2nc(C(F)F)[nH]c(=O)c21

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SYK P43405 14/20 0.35
FLT3 P36888 3/20 0.35
AURKB Q96GD4 3/20 0.35
ALDH1A1 P00352 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
MDM2 Q00987 1/20 0.32
SLC5A1 P13866 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
SCHEMBL2684217 0.78 ADORA2B (0.38) SYKFLT3AURKB
SCHEMBL1067757 0.75 ADORA2A (0.47) ALDH1A1
SCHEMBL1065416 0.72 ADORA2B (0.56) ALDH1A1MEN1KMT2A
SCHEMBL2685558 0.69 ADORA2B (0.41) SYKFLT3
SCHEMBL1065067 0.67 ADORA2A (0.44) SYKFLT3
SCHEMBL4407389 0.66 ADORA2B (0.59)
SCHEMBL1063503 0.65 ADORA2A (0.50) ALDH1A1
SCHEMBL1720688 0.63 CACNA2D1 (0.30)
SCHEMBL1065318 0.63 ADORA2B (0.58)
SCHEMBL2686196 0.62 ADORA2B (0.42) SYKFLT3AURKB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3727391-A1 PHARMACEUTICAL COMPOSITION FOR THE TREATMENT OF CANCER Impetis Biosciences Ltd. (IN) 2020-10-28 EP claimed
EP-2405917-A2 SUBSTITUTED FUSED PYRIMIDINE COMPOUNDS Advinus Therapeutics Private Limited (IN) 2012-01-18 EP claimed
WO-2010103547-A2 SUBSTITUTED FUSED PYRIMIDINE COMPOUNDS ADVINUS THERAPEUTICS PRIVATE LIMITED (IN) 2010-09-16 WO claimed
EP-3727391-A1 PHARMACEUTICAL COMPOSITION FOR THE TREATMENT OF CANCER Impetis Biosciences Ltd. (IN) 2020-10-28 EP disclosed
EP-2405917-A2 SUBSTITUTED FUSED PYRIMIDINE COMPOUNDS Advinus Therapeutics Private Limited (IN) 2012-01-18 EP disclosed
WO-2010103547-A2 SUBSTITUTED FUSED PYRIMIDINE COMPOUNDS ADVINUS THERAPEUTICS PRIVATE LIMITED (IN) 2010-09-16 WO disclosed