SCHEMBL2193785

SCHEMBL2193785

Nc1ccc(O)nc1Nc1ccccc1OC(F)(F)F

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.49
C1R P00736 1/20 0.45
CXCR2 P25025 1/20 0.40
AURKA O14965 2/20 0.40
GBA1 P04062 1/20 0.39
GAA P10253 1/20 0.39
TTK P33981 2/20 0.39
ATR Q13535 1/20 0.38
P2RX7 Q99572 1/20 0.37
PLK1 P53350 2/20 0.36
CCNA2 P20248 1/20 0.36
CDK2 P24941 1/20 0.36
CCNA1 P78396 1/20 0.36
PLK3 Q9H4B4 1/20 0.36
PLK2 Q9NYY3 1/20 0.36
SCN10A Q9Y5Y9 1/20 0.36
IGF1R P08069 2/20 0.35
ULK1 O75385 1/20 0.35
MEN1 O00255 1/20 0.34
MAPT P10636 1/20 0.34

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
SCHEMBL2195557 0.79 EPHX2 (0.46) EPHX2CXCR2AURKAGAAULK1
SCHEMBL2194871 0.79 L3MBTL1 (0.46) EPHX2C1RCXCR2AURKAGBA1
SCHEMBL2192476 0.77 MAPT (0.44) C1RAURKAMEN1MAPTKMT2A
SCHEMBL2192393 0.76 HTT (0.39) AURKAULK1MAPTKMT2A
SCHEMBL4057926 0.75 EPHX2 (0.49) EPHX2C1RCXCR2AURKAGBA1
SCHEMBL2193744 0.74 PDE5A (0.46) C1RAURKAIGF1RMEN1MAPT
SCHEMBL3192934 0.74 EPHX2 (0.57) EPHX2C1RCXCR2AURKAGBA1
SCHEMBL22543002 0.73 EPHX2 (0.58) EPHX2C1RCXCR2AURKAGBA1
SCHEMBL30754743 0.73 EPHX2 (0.58) EPHX2C1RCXCR2AURKAGBA1
SCHEMBL2196525 0.73 EPHX2 (0.48) EPHX2GAAULK1MEN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8507473-B2 3H-imidazo[4,5-b]pyridin-5-ol derivatives useful in the treatment of GPR81 receptor disorders ARENA PHARMACEUTICALS, INC. (US) 2013-08-13 US disclosed
US-20110172209-A1 3H-IMIDAZO[4,5-B]PYRIDIN-5-OL DERIVATIVES USEFUL IN THE TREATMENT OF GPR81 RECEPTOR DISORDERS ARENA PHARMACEUTICALS, INC. (US) 2011-07-14 US disclosed
WO-2010030360-A1 3H-IMIDAZO[4,5-b]PYRIDIN-5-OL DERIVATIVES USEFUL IN THE TREATMENT OF GPR81 RECEPTOR DISORDERS ARENA PHARMACEUTICALS, INC. (US) 2010-03-18 WO 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-20110172209-A1 3H-IMIDAZO[4,5-B]PYRIDIN-5-OL DERIVATIVES USEFUL IN THE TREATMENT OF GPR81 RECEPTOR DISORDERS GPR84, GPR119, GPR65 EPHX2 2830/4885C1R 2154/4885CXCR2 420/4885

“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.