SCHEMBL4097547

SCHEMBL4097547

CCN(c1nc(-c2c(OC)ccc(F)c2F)c2[nH]ncc2n1)c1ccc(C(F)(F)F)cc1Cl

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 6/20 0.33
DHFR P00374 1/20 0.31
CTSA P10619 1/20 0.31
HCRTR1 O43613 1/20 0.31
HCRTR2 O43614 1/20 0.31
MAP4K1 Q92918 1/20 0.30
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL4100797 0.93 FGFR2 (0.35)
SCHEMBL4091530 0.90 MAP4K1 (0.38) CRHR1DHFRCTSAMAP4K1
SCHEMBL4105401 0.90 MAPT (0.34) CRHR1DHFRMAP4K1KDM4E
SCHEMBL4103149 0.89 TRPA1 (0.32)
SCHEMBL4102639 0.87 CYP2C9 (0.35) CRHR1DHFRHCRTR1HCRTR2ALDH1A1
SCHEMBL4101972 0.86 CRHR1 (0.33) CRHR1DHFRKDM4E
SCHEMBL4109802 0.85 CRHR1 (0.34) CRHR1DHFRMAP4K1
SCHEMBL4106287 0.84 SMN1; SMN2 (0.35) CRHR1DHFRKDM4EALDH1A1
SCHEMBL4096321 0.84 DHFR (0.31) DHFRMAP4K1
SCHEMBL4098013 0.84 ALPL (0.33) CRHR1HCRTR1HCRTR2MAP4K1KDM4E

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-20090234117-A1 Pyrazolopyrimidine Derivative MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-09-17 US claimed
EP-1903045-A1 PYRAZOLOPYRIMIDINE DERIVATIVE Mitsubishi Tanabe Pharma Corporation (JP) 2008-03-26 EP claimed
US-20090234117-A1 Pyrazolopyrimidine Derivative MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-09-17 US disclosed
EP-1903045-A1 PYRAZOLOPYRIMIDINE DERIVATIVE Mitsubishi Tanabe Pharma Corporation (JP) 2008-03-26 EP 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-20090234117-A1 Pyrazolopyrimidine Derivative MC2R, CRHR1, AVPR2 CRHR1 2/4885DHFR 1568/4885CTSA 4397/4885

“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.