SCHEMBL1272253

SCHEMBL1272253

COc1ccc(-n2c(C)nc3c(C(F)(F)F)cccc32)c(C)c1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 14/20 0.49
NR1H3 Q13133 14/20 0.49
CRHR1 P34998 2/20 0.43
PDE2A O00408 1/20 0.37
PDE10A Q9Y233 1/20 0.37
METAP2 P50579 1/20 0.37
HTR3E A5X5Y0 1/20 0.36
HTR3B O95264 1/20 0.36
HTR3A P46098 1/20 0.36
HTR3D Q70Z44 1/20 0.36
HTR3C Q8WXA8 1/20 0.36

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
SCHEMBL1272279 0.89 NR1H2 (0.48) NR1H2NR1H3CRHR1
SCHEMBL1271040 0.84 NR1H2 (0.67) NR1H2NR1H3
SCHEMBL1271065 0.82 NR1H2 (0.46) NR1H2NR1H3PDE10A
SCHEMBL1272181 0.82 NR1H2 (0.56) NR1H2NR1H3CRHR1
SCHEMBL1272165 0.82 NR1H2 (0.67) NR1H2NR1H3
SCHEMBL1272150 0.81 NR1H2 (0.78) NR1H2NR1H3
SCHEMBL1271106 0.79 NR1H2 (0.79) NR1H2NR1H3
SCHEMBL1272198 0.79 NR1H2 (0.49) NR1H2NR1H3CRHR1HTR3EHTR3B
SCHEMBL1272009 0.79 NR1H2 (0.79) NR1H2NR1H3
SCHEMBL1272280 0.78 NR1H2 (0.78) NR1H2NR1H3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110034526-A1 Benzimidazole Compounds WYETH LLC (US) 2011-02-10 US disclosed
EP-2231617-A1 BENZIMIDAZOLE COMPOUNDS Wyeth LLC (US) 2010-09-29 EP disclosed
WO-2009086138-A1 BENZIMIDAZOLE COMPOUNDS WYETH (US) 2009-07-09 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110034526-A1 Benzimidazole Compounds NR1H4, NR1H2, NR1H3 NR1H2 2/4885NR1H3 3/4885CRHR1 1053/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.