SCHEMBL899221

SCHEMBL899221

Cc1nc(Cl)n(-c2ccc(F)cc2F)c1C(O)c1ccc(F)cc1Cl

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.36
GRM5 P41594 2/20 0.36
P2RX7 Q99572 3/20 0.35
NR3C2 P08235 2/20 0.32
PHGDH O43175 1/20 0.32
CNR1 P21554 5/20 0.32
CNR2 P34972 2/20 0.32
CYP3A4 P08684 2/20 0.31
MAPK13 O15264 1/20 0.31
MAPK12 P53778 1/20 0.31
MAPK11 Q15759 1/20 0.31
MAPK14 Q16539 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
SCHEMBL899125 0.93 NR3C2 (0.33) P2RX7NR3C2
SCHEMBL898897 0.88 NR3C2 (0.31) NR3C2
SCHEMBL898910 0.88 GLA (0.35) GLAGRM5P2RX7NR3C2CNR1
SCHEMBL899572 0.88 GRM5 (0.33) GLAGRM5P2RX7NR3C2MAPK13
SCHEMBL899021 0.87 NR3C2 (0.34) P2RX7NR3C2CYP3A4
SCHEMBL898060 0.86 TRPC5 (0.33) GLAGRM5NR3C2MAPK13MAPK12
SCHEMBL898920 0.85 NR3C2 (0.37) NR3C2MAPK13MAPK12MAPK11MAPK14
SCHEMBL900059 0.85 CRHR1 (0.38) P2RX7NR3C2CNR1
SCHEMBL899144 0.83 NR3C2 (0.32) NR3C2
SCHEMBL898935 0.83 NR3C2 (0.36) P2RX7NR3C2MAPK11MAPK14

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
EP-2621907-A1 FUNGICIDAL IMIDAZOLES E.I. Du Pont De Nemours And Company (US) 2013-08-07 EP claimed
US-20130143929-A1 FUNGICIDAL IMIDAZOLES EI DU PONT DE NEMOURS AND COMPANY (US) 2013-06-06 US claimed
WO-2012044650-A1 FUNGICIDAL IMIDAZOLES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2012-04-05 WO claimed
US-20130143929-A1 FUNGICIDAL IMIDAZOLES EI DU PONT DE NEMOURS AND COMPANY (US) 2013-06-06 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-20130143929-A1 FUNGICIDAL IMIDAZOLES CYP1A1, CYP1B1, CYP2E1 GLA 4314/4885GRM5 3322/4885P2RX7 961/4885

“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.