SCHEMBL9195100

SCHEMBL9195100

O=c1[nH]c(COc2ccccc2)nc2nccnc12

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.59
DAO P14920 1/20 0.52
NOS1 P29475 1/20 0.52
NPC1 O15118 2/20 0.49
TP53 P04637 1/20 0.49
TSHR P16473 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
RXFP1 Q9HBX9 1/20 0.48
HCAR2 Q8TDS4 11/20 0.47
PABPC1 P11940 1/20 0.45
PRMT5 O14744 1/20 0.40

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
SCHEMBL9194911 0.91 RAB9A (0.51) RAB9ADAONOS1NPC1TP53
SCHEMBL9196970 0.86 RAB9A (0.49) RAB9ADAONOS1NPC1SMN1; SMN2
SCHEMBL9191276 0.86 HCAR2 (0.51) RAB9ADAONOS1NPC1SMN1; SMN2
SCHEMBL9194818 0.86 RAB9A (0.49) RAB9ADAONOS1NPC1TP53
SCHEMBL9189988 0.83 HCAR2 (0.56) RAB9ATSHRHCAR2
SCHEMBL1872318 0.82 RAB9A (0.70) RAB9AHCAR2
SCHEMBL27943662 0.82 RAB9A (0.70) RAB9ADAONOS1NPC1TP53
SCHEMBL9196623 0.80 HCAR2 (0.40) RAB9ADAONPC1TP53SMN1; SMN2
SCHEMBL9287657 0.80 HCAR2 (0.47) RAB9ANPC1TP53SMN1; SMN2HCAR2
SCHEMBL9190029 0.79 ALDH1A1 (0.43) SMN1; SMN2HCAR2

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 8 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
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
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