SCHEMBL17025293

SCHEMBL17025293

Cc1ccc(C(F)(F)F)cc1[C@@H](C)O

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 8/20 0.61
LIPG Q9Y5X9 1/20 0.40
TAS2R14 Q9NYV8 1/20 0.38
SCN10A Q9Y5Y9 1/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HPGD P15428 1/20 0.37
HSD17B10 Q99714 1/20 0.37
CFTR P13569 1/20 0.37
KIF11 P52732 1/20 0.36
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36
HTR2B P41595 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
NOTUM Q6P988 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
SCHEMBL17025347 1.00 PDE2A (0.61) PDE2ALIPGTAS2R14SCN10AKDM4E
SCHEMBL18075239 0.86 PDE2A (0.68) PDE2ALIPGSCN10AKIF11HTR2A
SCHEMBL30481795 0.86 PDE2A (0.68) PDE2ALIPGSCN10AKIF11HTR2A
SCHEMBL12306470 0.84 PDE2A (0.46) PDE2ATAS2R14ALDH1A1KIF11HTR2A
SCHEMBL8750547 0.82 ALDH1A1 (0.42) PDE2ASCN10AKDM4EALDH1A1HPGD
SCHEMBL23675536 0.81 PDE2A (0.61) PDE2ALIPGSCN10AHTR2AHTR2C
SCHEMBL19696153 0.81 PDE2A (0.61) PDE2ALIPGSCN10AHTR2AHTR2C
SCHEMBL10107301 0.81 PDE2A (0.61) PDE2ALIPGSCN10AHTR2AHTR2C
SCHEMBL22717043 0.81 PDE2A (0.61) PDE2ALIPGSCN10AHTR2AHTR2C
SCHEMBL27624246 0.80 PDE2A (0.44) PDE2ATAS2R14KDM4EALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150239889-A1 PYRAZOLOPYRIMIDINE COMPOUND MITSUBISHI TANABE PHARMA CORPORATION (JP) 2015-08-27 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-20150239889-A1 PYRAZOLOPYRIMIDINE COMPOUND HIF1AN, EGLN2, EGLN3 PDE2A 2288/4885LIPG 4485/4885TAS2R14 2233/4885

“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.