SCHEMBL1625477

SCHEMBL1625477

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

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 2/20 0.49
DGAT2 Q96PD7 13/20 0.49
PRKAG1 P54619 1/20 0.46
PRKAA1 Q13131 1/20 0.46
PRKAB1 Q9Y478 1/20 0.46
MAPT P10636 1/20 0.44
ABL1 P00519 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
SCHEMBL1625269 0.99 NOTUM (0.49) NOTUMDGAT2PRKAG1PRKAA1PRKAB1
SCHEMBL1624849 0.96 DGAT2 (0.54) NOTUMDGAT2PRKAG1PRKAA1PRKAB1
SCHEMBL1625121 0.95 PRKAG1 (0.49) NOTUMDGAT2PRKAG1PRKAA1PRKAB1
SCHEMBL1623335 0.94 MAPT (0.49) NOTUMDGAT2PRKAG1PRKAA1PRKAB1
SCHEMBL1623246 0.94 MAPT (0.49) NOTUMDGAT2PRKAG1PRKAA1PRKAB1
SCHEMBL1625355 0.94 MAPT (0.43) NOTUMDGAT2PRKAG1PRKAA1PRKAB1
SCHEMBL1284103 0.94 CCNC (0.48) NOTUMDGAT2PRKAG1PRKAA1PRKAB1
SCHEMBL1283986 0.93 NOTUM (0.51) NOTUMDGAT2PRKAG1PRKAA1PRKAB1
SCHEMBL1624550 0.90 NOTUM (0.51) NOTUMPRKAG1PRKAA1PRKAB1MAPT
SCHEMBL1624664 0.89 NOTUM (0.52) NOTUMDGAT2MAPT

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 NOTUM 4463/4885DGAT2 719/4885PRKAG1 409/4885

“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.