SCHEMBL3058145

SCHEMBL3058145

Cc1ccc(-c2ccccc2C(=O)N2CCC2CN)cc1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 16/20 0.48
HCRTR2 O43614 16/20 0.48
LMNA P02545 2/20 0.43
TSHR P16473 1/20 0.42
RECQL P46063 1/20 0.42
SCN1A P35498 1/20 0.41
SCN2A Q99250 1/20 0.41
SCN3A Q9NY46 1/20 0.41
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL1398831 0.90 HCRTR1 (0.57) HCRTR1HCRTR2LMNATSHRRECQL
SCHEMBL1398834 0.90 HCRTR1 (0.57) HCRTR1HCRTR2LMNATSHRRECQL
SCHEMBL3058405 0.88 HCRTR1 (0.55) HCRTR1HCRTR2TSHRRECQLSCN1A
SCHEMBL1398919 0.87 HCRTR1 (0.47) HCRTR1HCRTR2LMNA
SCHEMBL3058147 0.87 MEN1 (0.48) HCRTR1HCRTR2LMNAALDH1A1
SCHEMBL3063124 0.85 TP53 (0.47) HCRTR1HCRTR2LMNATSHRALDH1A1
SCHEMBL4299213 0.83 CYP46A1 (0.39) HCRTR1HCRTR2
SCHEMBL20040364 0.82 HCRTR1 (0.64) HCRTR1HCRTR2LMNATSHRRECQL
SCHEMBL3318857 0.82 HCRTR1 (0.40) HCRTR1HCRTR2LMNATSHRRECQL
SCHEMBL3058143 0.81 HCRTR1 (0.49) HCRTR1HCRTR2LMNATSHRRECQL

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-20100222600-A1 AZETIDINE COMPOUNDS AS OREXIN RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD. (CH) 2010-09-02 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-20100222600-A1 AZETIDINE COMPOUNDS AS OREXIN RECEPTOR ANTAGONISTS HCRTR2, HCRTR1, NPY1R HCRTR1 2/4885HCRTR2 1/4885LMNA 3973/4885

“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.