SCHEMBL3346983

SCHEMBL3346983

C#Cc1cc2ncccn2n1.Cc1cc2cc-2c1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
APOBEC3A P31941 1/20 0.40
APOBEC3G Q9HC16 1/20 0.40
PIK3CG P48736 1/20 0.33
GRM5 P41594 1/20 0.32
PDGFRB P09619 2/20 0.31
KDR P35968 2/20 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
Benzene SCHEMBL1991469 0.86 APOBEC3A (0.51) APOBEC3AAPOBEC3GPIK3CGPDGFRBKDR
Toluene SCHEMBL9903136 0.86 APOBEC3A (0.43) APOBEC3AAPOBEC3GPIK3CGPDGFRBKDR
SCHEMBL3347528 0.85 APOBEC3A (0.42) APOBEC3AAPOBEC3GPDGFRBKDR
SCHEMBL3345963 0.84 APOBEC3A (0.41) APOBEC3AAPOBEC3G
SCHEMBL3346197 0.81 APOBEC3A (0.37) APOBEC3AAPOBEC3GPIK3CG
Pyridine SCHEMBL3347792 0.81 APOBEC3A (0.46) APOBEC3AAPOBEC3G
SCHEMBL3346774 0.79 APOBEC3A (0.39) APOBEC3AAPOBEC3G
SCHEMBL3347037 0.79 APOBEC3A (0.42) APOBEC3AAPOBEC3GKDR
SCHEMBL3348826 0.78 APOBEC3A (0.41) APOBEC3AAPOBEC3G
Cyclohexene SCHEMBL9903643 0.78 APOBEC3A (0.41) APOBEC3AAPOBEC3G

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
WO-2010063487-A1 PYRAZOLOPYRIMIDINES, A PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICINE MERZ PHARMA GMBH & CO. KGAA (DE) 2010-06-10 WO claimed
WO-2010063487-A1 PYRAZOLOPYRIMIDINES, A PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICINE MERZ PHARMA GMBH & CO. KGAA (DE) 2010-06-10 WO disclosed