SCHEMBL1922983

SCHEMBL1922983

CCC=Cc1c(C)nn2c(-c3ccc(Cl)cc3Cl)c(C)oc12

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CRHR1 P34998 12/20 0.40
▸ DPP4 P27487 8/20 0.40
▸ DPP8 Q6V1X1 2/20 0.38
▸ DPP9 Q86TI2 1/20 0.38
▸ CYP3A4 P08684 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ CYP2C19 P33261 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
SCHEMBL1922981 1.00 CRHR1 (0.40) CRHR1DPP4DPP8DPP9CYP3A4
SCHEMBL1922267 0.85 DPP4 (0.40) CRHR1DPP4DPP8CYP3A4CYP2C9
SCHEMBL2641372 0.81 DPP4 (0.42) CRHR1DPP4DPP8DPP9CYP3A4
SCHEMBL1922607 0.79 DPP4 (0.36) CRHR1DPP4DPP8CYP2C9CYP2C19
SCHEMBL1922992 0.78 DPP4 (0.42) CRHR1DPP4DPP8DPP9CYP3A4
SCHEMBL1922301 0.78 DPP4 (0.44) CRHR1DPP4DPP8DPP9CYP3A4
SCHEMBL1922300 0.78 DPP4 (0.42) CRHR1DPP4DPP8DPP9CYP3A4
SCHEMBL12360891 0.76 CRHR1 (0.53) CRHR1DPP4
SCHEMBL1922585 0.76 DPP4 (0.44) CRHR1DPP4DPP8DPP9CYP3A4
SCHEMBL1922996 0.76 CRHR1 (0.39) CRHR1DPP4DPP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2011529943-A — — 2011-12-15 — — JP claimed
US-7994203-B2 Organic compounds NOVARTIS AG (CH) 2011-08-09 — — US claimed
EP-2328902-A1 PYRAZOLO [5,1-B]OXAZOLE DERIVATIVES AS CRF1 ANTAGONISTS Novartis AG (CH) 2011-06-08 — — EP claimed
WO-2010015628-A1 PYRAZOLO [5,1-B] OXAZOLE DERIVATIVES AS CRF1 ANTAGONISTS NOVARTIS AG (CH) 2010-02-11 — — WO claimed
US-20100035874-A1 Organic compounds NOVARTIS AG (CH) 2010-02-11 — — US claimed
US-7994203-B2 Organic compounds NOVARTIS AG (CH) 2011-08-09 — — US disclosed
EP-2328902-A1 PYRAZOLO [5,1-B]OXAZOLE DERIVATIVES AS CRF1 ANTAGONISTS Novartis AG (CH) 2011-06-08 — — EP 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

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 CRHR1 2/4885DPP4 958/4885DPP8 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.

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