SCHEMBL4107183

SCHEMBL4107183

CCN(c1nc(-c2ccccc2C)c2[nH]ncc2n1)c1ccc(C(F)(F)F)cc1Cl

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 10/20 0.35
TRPA1 O75762 3/20 0.35
NR1H2 P55055 2/20 0.33
NR1H3 Q13133 2/20 0.33
GPBAR1 Q8TDU6 2/20 0.33
TRPM8 Q7Z2W7 2/20 0.32
TRPV1 Q8NER1 2/20 0.32
PDE2A O00408 1/20 0.32
PDE10A Q9Y233 1/20 0.32
METAP2 P50579 1/20 0.32
DHFR P00374 1/20 0.32

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
SCHEMBL4107196 0.94 RXFP1 (0.38) CRHR1TRPA1NR1H2NR1H3GPBAR1
SCHEMBL4095952 0.92 CRHR1 (0.41) CRHR1TRPA1TRPM8TRPV1
SCHEMBL4100749 0.91 METAP2 (0.36) CRHR1TRPA1NR1H2NR1H3TRPM8
SCHEMBL4102310 0.91 CRHR1 (0.33) CRHR1TRPA1NR1H2NR1H3TRPM8
SCHEMBL4101998 0.90 HPGD (0.35) CRHR1TRPA1NR1H2NR1H3TRPM8
SCHEMBL4106287 0.90 SMN1; SMN2 (0.35) CRHR1TRPA1GPBAR1TRPM8PDE2A
SCHEMBL4090274 0.89 TRPA1 (0.37) CRHR1TRPA1GPBAR1TRPM8TRPV1
SCHEMBL4090336 0.89 TRPA1 (0.38) CRHR1TRPA1METAP2
SCHEMBL4102524 0.88 CRHR1 (0.33) CRHR1TRPA1METAP2
SCHEMBL4097958 0.88 TRPA1 (0.37) CRHR1TRPA1METAP2

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 2 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 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 2/4885TRPA1 688/4885NR1H2 389/4885

“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.