SCHEMBL7751663

SCHEMBL7751663

Cn1cncc1C(N)Cc1ccc(C#N)c(F)c1

nearest known ligand 0.44

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FNTA P49354 1/20 0.41
FNTB P49356 1/20 0.41
NSD2 O96028 1/20 0.39

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
Hydrochloric Acid SCHEMBL7755641 0.99 FNTA (0.41) FNTAFNTBNSD2
SCHEMBL8128480 0.87 FNTA (0.42) FNTAFNTB
SCHEMBL8194918 0.84 FNTA (0.40) FNTAFNTB
Hydrochloric Acid SCHEMBL7757569 0.81 CYP11B1 (0.39) FNTAFNTB
SCHEMBL7567592 0.80 CYP11B1 (0.46) FNTAFNTB
SCHEMBL7183607 0.79 FNTA (0.47) FNTAFNTB
Hydrochloric Acid SCHEMBL7756190 0.78 CYP11B1 (0.32)
SCHEMBL7757384 0.77 FNTA (0.48) FNTAFNTB
SCHEMBL8186174 0.76 FNTA (0.38) FNTAFNTB
SCHEMBL8125159 0.76 PGGT1B (0.55) FNTAFNTB

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
WO-2001051126-A1 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 2001-07-19 WO disclosed
WO-2001051125-A1 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 2001-07-19 WO disclosed
WO-2001051127-A1 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 2001-07-19 WO disclosed
WO-2000034437-A2 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 2000-06-15 WO disclosed