SCHEMBL875076

SCHEMBL875076

OCc1ccc(Oc2ccc(Cl)c(C(F)(F)F)c2)nc1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PLA2G7 Q13093 12/20 0.44
KDR P35968 2/20 0.43
BRAF P15056 1/20 0.43
IDO1 P14902 2/20 0.43
PPARG P37231 1/20 0.42
PPARA Q07869 1/20 0.42
KDM4E B2RXH2 1/20 0.41
POLB P06746 1/20 0.41
MAPK8 P45983 1/20 0.41
MAPK10 P53779 1/20 0.41
NR1H2 P55055 1/20 0.40
NR1H3 Q13133 1/20 0.40

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
SCHEMBL875590 0.90 PLA2G7 (0.43) PLA2G7KDRBRAFIDO1PPARG
SCHEMBL29918246 0.86 KIF11 (0.40) PLA2G7KDRPOLBNR1H2NR1H3
SCHEMBL17459901 0.86 KIF11 (0.40) PLA2G7KDRPOLBNR1H2NR1H3
SCHEMBL875436 0.85 POLB (0.44) PLA2G7KDRBRAFIDO1PPARG
SCHEMBL8009571 0.84 HAO1 (0.48) KDM4EPOLBMAPK8MAPK10NR1H2
SCHEMBL29918384 0.82 IDO1 (0.50) PLA2G7KDRBRAFIDO1PPARG
SCHEMBL875664 0.82 IDO1 (0.50) PLA2G7KDRBRAFIDO1PPARG
SCHEMBL875283 0.80 BRAF (0.44) PLA2G7KDRBRAFPPARGPPARA
SCHEMBL875480 0.80 ALDH1A1 (0.62) PLA2G7KDRBRAFPPARGPPARA
SCHEMBL18235655 0.77 AR (0.52) PLA2G7IDO1PPARGPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140378487-A1 TRICYCLIC COMPOUNDS, PREPARATION METHODS, AND THEIR USES GLAXO GROUP LTD (GB) 2014-12-25 US disclosed
US-8871928-B2 Tricyclic compounds, preparation methods, and their uses GLAXO GROUP LIMITED (GB) 2014-10-28 US disclosed
EP-2619203-A1 TRICYCLIC COMPOUNDS, PREPARATION METHODS, AND THEIR USES Glaxo Group Limited (GB) 2013-07-31 EP disclosed
US-20130178488-A1 TRICYCLIC COMPOUNDS, PREPARATION METHODS, AND THEIR USES GLAXO GROUP LIMITED (GB) 2013-07-11 US disclosed
WO-2012037782-A1 TRICYCLIC COMPOUNDS, PREPARATION METHODS, AND THEIR USES GLAXO GROUP LIMITED (GB) 2012-03-29 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 (2 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-20140378487-A1 TRICYCLIC COMPOUNDS, PREPARATION METHODS, AND THEIR USES LIPG, PCSK9, ENPP2 PLA2G7 22/4885KDR 1285/4885BRAF 2384/4885
US-20130178488-A1 TRICYCLIC COMPOUNDS, PREPARATION METHODS, AND THEIR USES LIPG, PCSK9, ENPP2 PLA2G7 22/4885KDR 1285/4885BRAF 2384/4885

“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.