SCHEMBL6409385

SCHEMBL6409385

Cc1ncc(C(Cc2ccc(C#N)c(F)c2)N2CCN(Cc3cccc(O)n3)C(=O)C2)[nH]1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 4/20 0.36
WDR77 Q9BQA1 3/20 0.36
RET P07949 2/20 0.33
DAO P14920 1/20 0.32
DPP4 P27487 1/20 0.32
PDE2A O00408 1/20 0.31
CACNA1H O95180 3/20 0.31
GPR52 Q9Y2T5 1/20 0.30
KCNJ1 P48048 2/20 0.30

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
SCHEMBL6412550 0.87 PRMT5 (0.34) PRMT5WDR77PDE2ACACNA1H
SCHEMBL6413460 0.87 PRMT5 (0.32) PRMT5WDR77DPP4
SCHEMBL6411741 0.80 FNTA (0.34) PRMT5WDR77DAOGPR52
SCHEMBL6408970 0.77 PRMT5 (0.31) PRMT5WDR77
SCHEMBL7166984 0.75 PRMT5 (0.41) PRMT5WDR77RETDAODPP4
SCHEMBL7165817 0.75 FNTA (0.40) PRMT5WDR77RETPDE2ACACNA1H
SCHEMBL7566917 0.74 BCAT2 (0.32) PRMT5WDR77CACNA1HGPR52
SCHEMBL6409378 0.74 HTR1A (0.35)
SCHEMBL7648195 0.72 GPR119 (0.43) RET
SCHEMBL6410691 0.71 CACNA1H (0.30) CACNA1H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1090012-A4 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE MERCK & CO INC (US) 2005-04-06 EP disclosed
US-6562823-B1 Inhibition of farnesyl-protein transferase has been shown to block the growth of Ras-transformed cells in soft agar MERCK & CO., INC. 2003-05-13 US disclosed
EP-1090012-A1 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 2001-04-11 EP disclosed
WO-2000001702-A1 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 2000-01-13 WO disclosed