SCHEMBL9968348

SCHEMBL9968348

Cn1c(-c2cc(N3CCC(C(=O)N4CCCCC4)CC3)ncc2Cl)nc2ccccc21

nearest known ligand 0.50

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SMO Q99835 18/20 0.50
HCRTR1 O43613 1/20 0.42
HCRTR2 O43614 1/20 0.42

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
SCHEMBL9931713 0.99 SMO (0.51) SMO
SCHEMBL9932145 0.91 SMO (0.49) SMO
SCHEMBL9932796 0.89 SMO (0.47) SMO
SCHEMBL9968319 0.86 MEN1 (0.46) SMO
SCHEMBL1533952 0.86 SMO (0.48) SMO
SCHEMBL9932547 0.85 SMO (0.46) SMO
SCHEMBL9968302 0.85 SMO (0.44) SMO
SCHEMBL9932138 0.85 SMO (0.54) SMO
SCHEMBL9968324 0.83 MEN1 (0.44) SMO
SCHEMBL9931986 0.83 SMO (0.56) SMO

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
US-20120157471-A1 BENZIMIDAZOLE DERIVATIVES PFIZER INC. (US) 2012-06-21 US 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-20120157471-A1 BENZIMIDAZOLE DERIVATIVES SMO, RB1, GLI1 SMO 1/4885HCRTR1 1633/4885HCRTR2 2902/4885

“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.