SCHEMBL9932379

SCHEMBL9932379

Cn1c(-c2cc(N3CCC(O)(CN4CCCC4=O)CC3)ncc2Cl)nc2ccccc21

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 1/20 0.39
SMO Q99835 7/20 0.38
SLC6A2 P23975 1/20 0.38
SLC6A3 Q01959 1/20 0.38
HCRTR1 O43613 8/20 0.37
HCRTR2 O43614 8/20 0.37
KCNH2 Q12809 2/20 0.37
LTC4S Q16873 1/20 0.37
CDK9 P50750 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
SCHEMBL9932304 0.95 PDE10A (0.38) PDE10ASMOSLC6A2SLC6A3HCRTR1
SCHEMBL9968356 0.85 KDM4E (0.41) SMO
SCHEMBL9933199 0.84 PTPN11 (0.44) PDE10ASMO
SCHEMBL9968340 0.84 MEN1 (0.40) SMO
SCHEMBL9933062 0.82 PDE2A (0.42) SMO
SCHEMBL9931789 0.81 PTPN11 (0.43) SMO
SCHEMBL12841368 0.80 MEN1 (0.34) SMOCDK9
SCHEMBL9933101 0.79 CYP2D6 (0.45) SMO
SCHEMBL9932531 0.78 MEN1 (0.43) SMO
SCHEMBL9968319 0.78 MEN1 (0.46) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120157471-A1 BENZIMIDAZOLE DERIVATIVES PFIZER INC. (US) 2012-06-21 US disclosed
US-20120157471-A1 BENZIMIDAZOLE DERIVATIVES PFIZER INC. (US) 2012-06-21 US disclosed
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 PDE10A 1879/4885SMO 1/4885SLC6A2 4539/4885

“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.