SCHEMBL8551152

SCHEMBL8551152

NC(=O)c1ccc2c(c1)nc(/C=C/c1ccccc1)n2-c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GFER P55789 1/20 0.53
HSD17B10 Q99714 1/20 0.50
FGFR1 P11362 1/20 0.50
THRB P10828 1/20 0.47
MEN1 O00255 3/20 0.46
POLB P06746 3/20 0.46
KMT2A Q03164 3/20 0.46
GAA P10253 1/20 0.45
JAK2 O60674 1/20 0.45
JAK1 P23458 1/20 0.45
TYK2 P29597 1/20 0.45
JAK3 P52333 1/20 0.45
KLK7 P49862 1/20 0.44

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
SCHEMBL8551161 1.00 GFER (0.53) GFERHSD17B10FGFR1THRBMEN1
SCHEMBL6585289 0.81 ALDH1A1 (0.59) GFERFGFR1MEN1POLBKMT2A
SCHEMBL6585280 0.81 ALDH1A1 (0.59) GFERFGFR1MEN1POLBKMT2A
SCHEMBL8550750 0.80 KDM4E (0.64) GFERMEN1POLBKMT2AGAA
SCHEMBL6583378 0.80 KDM4E (0.64) GFERMEN1POLBKMT2AGAA
SCHEMBL6583386 0.80 KDM4E (0.64) GFERMEN1POLBKMT2AGAA
Hydrochloric Acid SCHEMBL6581363 0.80 ALDH1A1 (0.58) GFERFGFR1MEN1POLBKMT2A
Hydrochloric Acid SCHEMBL6581370 0.80 ALDH1A1 (0.58) GFERFGFR1MEN1POLBKMT2A
SCHEMBL5809308 0.79 FGFR1 (0.57) HSD17B10FGFR1THRBMEN1KMT2A
SCHEMBL8551282 0.78 PDE10A (0.54) GFERFGFR1MEN1POLBKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0846689-A1 Benzimidazole compounds PFIZER INC. (US) 1998-06-10 EP disclosed