SCHEMBL9190029

SCHEMBL9190029

COCc1nc2nccnc2c(=O)[nH]1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
HCAR2 Q8TDS4 13/20 0.42
CCNE1 P24864 1/20 0.39
CDK2 P24941 1/20 0.39
PDE2A O00408 1/20 0.37
PDE1A P54750 1/20 0.37
PDE1B Q01064 1/20 0.37
PDE1C Q14123 1/20 0.37
CACNA1H O95180 1/20 0.35

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
SCHEMBL9191397 0.90 ALDH1A1 (0.39) ALDH1A1SMN1; SMN2HCAR2CCNE1CDK2
SCHEMBL9194026 0.88 HCAR2 (0.44) ALDH1A1SMN1; SMN2HCAR2CCNE1CDK2
SCHEMBL6440045 0.84 HCAR2 (0.43) ALDH1A1HCAR2CCNE1CDK2
SCHEMBL9195013 0.83 HCAR2 (0.37) HCAR2PDE1APDE1BPDE1C
SCHEMBL9191469 0.83 HCAR2 (0.47) ALDH1A1HCAR2PDE2APDE1APDE1B
SCHEMBL9191276 0.83 HCAR2 (0.51) ALDH1A1SMN1; SMN2HCAR2
SCHEMBL3817859 0.81 TNKS2 (0.44) ALDH1A1SMN1; SMN2HCAR2
SCHEMBL9195100 0.79 RAB9A (0.59) SMN1; SMN2HCAR2
SCHEMBL9191459 0.78 HCAR2 (0.40) ALDH1A1HCAR2
SCHEMBL9189988 0.77 HCAR2 (0.56) HCAR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0399856-B1 Pteridin-4 (3H)-ones, processes for their preparation and medicaments containing them LIPHA (FR) 1995-08-09 EP claimed
US-5270465-A 4(3H)-pteridinone compounds LIPHA, LYONNAISE INDUSTRILLE PHARMACEUTIQUE (FR) 1993-12-14 US claimed
US-5167949-A Antiallergic LIPHA, LYONNAISE INDUSTRIELLE PHARMACEUTIQUE (FR) 1992-12-01 US claimed
EP-0399856-A1 Pteridin-4 (3H)-ones, processes for their preparation and medicaments containing them LIPHA, LYONNAISE INDUSTRIELLE PHARMACEUTIQUE (FR) 1990-11-28 EP claimed
JP-2304089-A None JP disclosed
EP-0399856-B1 Pteridin-4 (3H)-ones, processes for their preparation and medicaments containing them LIPHA (FR) 1995-08-09 EP disclosed
US-5270465-A 4(3H)-pteridinone compounds LIPHA, LYONNAISE INDUSTRILLE PHARMACEUTIQUE (FR) 1993-12-14 US disclosed
US-5167949-A Antiallergic LIPHA, LYONNAISE INDUSTRIELLE PHARMACEUTIQUE (FR) 1992-12-01 US disclosed
JP-H02304089-A 4(3H)-PTERIDINONE, ITS PRODUCTION, ANTIALLERGIC AGENT AND BRONCHOCONSTRICTION PREVENTIVE LIPHA (LYON IND PHARMACEUT) 1990-12-17 JP disclosed
EP-0399856-A1 Pteridin-4 (3H)-ones, processes for their preparation and medicaments containing them LIPHA, LYONNAISE INDUSTRIELLE PHARMACEUTIQUE (FR) 1990-11-28 EP disclosed