SCHEMBL9932932

SCHEMBL9932932

Cn1c(-c2cc(N3C[C@@H]4[C@H](C3)[C@@H]4NS(C)(=O)=O)ncc2Cl)nc2ccccc21

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SMO Q99835 15/20 0.44
PDE10A Q9Y233 2/20 0.38
HSD11B1 P28845 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL9932931 1.00 SMO (0.44) SMOPDE10AHSD11B1MEN1KMT2A
SCHEMBL9932935 1.00 SMO (0.44) SMOPDE10AHSD11B1MEN1KMT2A
SCHEMBL9931790 0.91 SMO (0.50) SMOPDE10AHSD11B1MEN1KMT2A
SCHEMBL9971182 0.89 HSD11B1 (0.36) SMOPDE10AHSD11B1MEN1KMT2A
SCHEMBL9932948 0.87 CYP2C9 (0.41) SMOPDE10AMEN1KMT2A
SCHEMBL9932946 0.87 CYP2C9 (0.41) SMOPDE10AMEN1KMT2A
SCHEMBL9932950 0.87 CYP2C9 (0.41) SMOPDE10AMEN1KMT2A
SCHEMBL9932847 0.86 SMO (0.45) SMOPDE10AMEN1KMT2A
SCHEMBL9932851 0.86 SMO (0.45) SMOPDE10AMEN1KMT2A
SCHEMBL9932849 0.86 SMO (0.45) SMOPDE10AMEN1KMT2A

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 1/4885PDE10A 1879/4885HSD11B1 3610/4885

“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.