SCHEMBL9932077

SCHEMBL9932077

Cn1c(-c2nc(N3CCC(NC(=O)O)CC3)ncc2Cl)nc2ccccc21

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMO Q99835 11/20 0.47
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
FAAH O00519 1/20 0.41
EPHX2 P34913 1/20 0.41
CKS1B P61024 2/20 0.41
SKP1 P63208 2/20 0.41
SKP2 Q13309 2/20 0.41
MKNK1 Q9BUB5 1/20 0.41
MKNK2 Q9HBH9 1/20 0.41
DRD4 P21917 1/20 0.40
GRM2 Q14416 1/20 0.40
PIK3CB P42338 1/20 0.40

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
SCHEMBL9968521 0.89 CKS1B (0.51) SMOCKS1BSKP1SKP2
SCHEMBL9932881 0.86 SMO (0.60) SMOMEN1KMT2AMKNK1MKNK2
SCHEMBL9932472 0.86 SMO (0.66) SMO
SCHEMBL9968423 0.85 SMO (0.47) SMOMEN1KMT2AMKNK1MKNK2
SCHEMBL1533965 0.84 MKNK1 (0.54) SMOMEN1KMT2AMKNK1MKNK2
SCHEMBL9932312 0.82 SMO (0.48) SMOMEN1KMT2AFAAHEPHX2
SCHEMBL9931835 0.82 SMO (0.61) SMOMEN1KMT2ACKS1BSKP1
SCHEMBL9932685 0.82 SMO (0.54) SMO
SCHEMBL9931706 0.82 SMO (0.63) SMOMEN1KMT2ADRD4GRM2
SCHEMBL1533944 0.82 SMO (0.48) SMOMEN1KMT2AMKNK1MKNK2

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 1/4885MEN1 1168/4885KMT2A 310/4885

“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.