SCHEMBL2997378

SCHEMBL2997378

CCOC(=O)c1c(CCc2ccncc2)c2cc(-c3ccc(C(F)(F)F)cn3)ccc2n1-c1ccc(OC(C)C)cc1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGES O14684 3/20 0.37
KDM4E B2RXH2 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
MAOB P27338 1/20 0.35
PPARA Q07869 3/20 0.35
PPARG P37231 2/20 0.35
CXCR3 P49682 2/20 0.35
PPARD Q03181 1/20 0.34
POLB P06746 1/20 0.34
SCN9A Q15858 2/20 0.34
AKR1C3 P42330 2/20 0.34
AKR1C2 P52895 1/20 0.34
MLYCD O95822 1/20 0.34
ALOX5AP P20292 1/20 0.33
DAGLB Q8NCG7 1/20 0.33
PLA2G4A P47712 1/20 0.33

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
SCHEMBL3009470 0.91 PTGES (0.43) PTGESPPARAPPARGCXCR3PLA2G4A
SCHEMBL3008051 0.90 KDM4E (0.39) PTGESKDM4EL3MBTL1MAOBPPARA
SCHEMBL333994 0.89 PTGES (0.37) PTGESKDM4EL3MBTL1MAOBPPARA
SCHEMBL3001790 0.87 KDM4E (0.40) PTGESKDM4EL3MBTL1MAOBPPARA
SCHEMBL2997500 0.86 KDM4E (0.40) PTGESKDM4EL3MBTL1MAOBPPARA
SCHEMBL3001229 0.85 PTGES (0.35) PTGESKDM4EL3MBTL1MAOBPPARA
SCHEMBL3001233 0.85 PTGES (0.35) PTGESKDM4EL3MBTL1MAOBPPARA
SCHEMBL3006452 0.85 KDM4E (0.39) PTGESKDM4EL3MBTL1MAOBPPARA
SCHEMBL3001004 0.85 KDM4E (0.39) PTGESKDM4EL3MBTL1MAOBPPARA
SCHEMBL3000835 0.85 KMT2A (0.43) PTGESKDM4EL3MBTL1PPARAPPARG

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-20100197687-A1 Indoles Useful in the Treatment of Inflammation BIOLIPOX AB (SE) 2010-08-05 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-20100197687-A1 Indoles Useful in the Treatment of Inflammation IDO1, IDO2, TPH1 PTGES 33/4885KDM4E 1317/4885L3MBTL1 2062/4885

“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.