SCHEMBL1922331

SCHEMBL1922331

Cc1nn2c(-c3ccc(Cl)cc3Cl)c(C)oc2c1-n1nc(N2CCNC2=O)cc1C

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 8/20 0.35
CRHR1 P34998 7/20 0.34
DPP8 Q6V1X1 1/20 0.33
DPP9 Q86TI2 1/20 0.33
CNR1 P21554 2/20 0.33
CNR2 P34972 2/20 0.33
HTR2A P28223 1/20 0.32
HTR2C P28335 1/20 0.32
HTR2B P41595 1/20 0.32
KDM4E B2RXH2 1/20 0.31
IDH1 O75874 1/20 0.31

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
SCHEMBL1924429 0.86 CRHR1 (0.34) DPP4CRHR1DPP8DPP9
SCHEMBL1922467 0.80 DPP4 (0.42) DPP4CRHR1DPP8DPP9
SCHEMBL1922290 0.79 CRHR1 (0.37) DPP4CRHR1DPP8DPP9
SCHEMBL2258055 0.76 PTGS1 (0.39) DPP4CRHR1DPP8CNR1CNR2
SCHEMBL1922397 0.76 CRHR1 (0.37) DPP4CRHR1DPP8
SCHEMBL1922037 0.73 DPP4 (0.45) DPP4DPP8DPP9KDM4E
SCHEMBL1922525 0.73 DPP4 (0.44) DPP4CRHR1DPP8
SCHEMBL1922961 0.72 CRHR1 (0.37) CRHR1
SCHEMBL1922210 0.71 CRHR1 (0.37) DPP4CRHR1DPP8
SCHEMBL1923091 0.71 DPP4 (0.39) DPP4CRHR1DPP8CNR1CNR2

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 12 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
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.