SCHEMBL1624849

SCHEMBL1624849

COc1ccc2[nH]c(-c3cc(N4CCC[C@@H](C(=O)N5CCCC5)C4)ccc3Cl)nc2c1

nearest known ligand 0.54

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DGAT2 Q96PD7 18/20 0.54
PRKAG1 P54619 1/20 0.47
PRKAA1 Q13131 1/20 0.47
PRKAB1 Q9Y478 1/20 0.47
NOTUM Q6P988 1/20 0.44

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
SCHEMBL1625477 0.96 NOTUM (0.49) DGAT2PRKAG1PRKAA1PRKAB1NOTUM
SCHEMBL1625269 0.95 NOTUM (0.49) DGAT2PRKAG1PRKAA1PRKAB1NOTUM
SCHEMBL1625121 0.91 PRKAG1 (0.49) DGAT2PRKAG1PRKAA1PRKAB1NOTUM
SCHEMBL1623335 0.90 MAPT (0.49) DGAT2PRKAG1PRKAA1PRKAB1NOTUM
SCHEMBL1623246 0.90 MAPT (0.49) DGAT2PRKAG1PRKAA1PRKAB1NOTUM
SCHEMBL1284103 0.89 CCNC (0.48) DGAT2PRKAG1PRKAA1PRKAB1NOTUM
SCHEMBL1625355 0.89 MAPT (0.43) DGAT2PRKAG1PRKAA1PRKAB1NOTUM
SCHEMBL1625521 0.89 DGAT2 (0.52) DGAT2NOTUM
SCHEMBL1625165 0.89 DGAT2 (0.52) DGAT2NOTUM
SCHEMBL1283986 0.89 NOTUM (0.51) DGAT2PRKAG1PRKAA1PRKAB1NOTUM

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8835648-B2 Hedgehog pathway antagonists and therapeutic applications thereof SIENA BIOTECH S.P.A. (IT) 2014-09-16 US disclosed
US-8835648-B2 Hedgehog pathway antagonists and therapeutic applications thereof SIENA BIOTECH S.P.A. (IT) 2014-09-16 US disclosed
US-20120088752-A1 HEDGEHOG PATHWAY ANTAGONISTS AND THERAPEUTIC APPLICATIONS THEREOF SIENA BIOTECH S.P.A. (IT) 2012-04-12 US disclosed
US-20120088752-A1 HEDGEHOG PATHWAY ANTAGONISTS AND THERAPEUTIC APPLICATIONS THEREOF SIENA BIOTECH S.P.A. (IT) 2012-04-12 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-20120088752-A1 HEDGEHOG PATHWAY ANTAGONISTS AND THERAPEUTIC APPLICATIONS THEREOF SHH, GLI1, SMO DGAT2 719/4885PRKAG1 409/4885PRKAA1 1460/4885

“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.