SCHEMBL2260849

SCHEMBL2260849

CCc1nn2c(-c3ccc(Cl)cc3Cl)c(C)oc2c1N

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 10/20 0.41
CRHR1 P34998 7/20 0.40
DPP8 Q6V1X1 2/20 0.39
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
DPP9 Q86TI2 1/20 0.37

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
SCHEMBL2255880 0.86 CRHR1 (0.40) DPP4CRHR1DPP8
SCHEMBL1922301 0.85 DPP4 (0.44) DPP4CRHR1DPP8CYP3A4CYP2C9
SCHEMBL1922183 0.82 MARS1 (0.40) DPP4CRHR1DPP8
SCHEMBL1922556 0.80 DPP4 (0.40) DPP4CRHR1DPP8
SCHEMBL12360979 0.80 KDM4E (0.39) DPP4CRHR1DPP8CYP3A4CYP2C9
SCHEMBL1922346 0.79 MAPT (0.46) DPP4DPP8DPP9
SCHEMBL1921891 0.79 DPP4 (0.41) DPP4CRHR1
SCHEMBL1922558 0.79 CRHR1 (0.41) DPP4CRHR1
SCHEMBL2257669 0.79 DPP4 (0.44) DPP4CRHR1DPP8CYP3A4CYP2C9
SCHEMBL1922231 0.78 OPRM1 (0.41) DPP4CYP3A4CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7994203-B2 Organic compounds NOVARTIS AG (CH) 2011-08-09 US disclosed
US-7994203-B2 Organic compounds NOVARTIS AG (CH) 2011-08-09 US disclosed
US-7994203-B2 Organic compounds NOVARTIS AG (CH) 2011-08-09 US disclosed
WO-2010015628-A1 PYRAZOLO [5,1-B] OXAZOLE DERIVATIVES AS CRF1 ANTAGONISTS NOVARTIS AG (CH) 2010-02-11 WO disclosed
US-20100035874-A1 Organic compounds NOVARTIS AG (CH) 2010-02-11 US disclosed
US-20100035874-A1 Organic compounds NOVARTIS AG (CH) 2010-02-11 US disclosed
US-20100035874-A1 Organic compounds NOVARTIS AG (CH) 2010-02-11 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-20100035874-A1 Organic compounds CRH, CRHR1, CRHR2 DPP4 958/4885CRHR1 2/4885DPP8 593/4885

“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.