SCHEMBL2997573

SCHEMBL2997573

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

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 4/20 0.44
PTGES O14684 3/20 0.39
PPARG P37231 2/20 0.38
PPARA Q07869 2/20 0.38
KDM4E B2RXH2 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CYP3A4 P08684 2/20 0.37
CYP2C9 P11712 2/20 0.37
POLB P06746 1/20 0.36
SCN9A Q15858 2/20 0.36
MAOB P27338 1/20 0.36
PTGS1 P23219 1/20 0.36
MAPT P10636 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
TP53 P04637 1/20 0.34
GCK P35557 1/20 0.34
THRB P10828 1/20 0.34
MLYCD O95822 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
SCHEMBL3010510 0.93 PTGES (0.38) ALOX5APPTGESPPARGPPARAKDM4E
Hydrochloric Acid SCHEMBL3010507 0.92 PTGES (0.38) ALOX5APPTGESPPARGPPARAKDM4E
SCHEMBL3001790 0.90 KDM4E (0.40) ALOX5APPTGESPPARGPPARAKDM4E
SCHEMBL2997313 0.90 ALOX5AP (0.45) ALOX5APPTGESPPARGPPARACYP3A4
SCHEMBL2997500 0.89 KDM4E (0.40) ALOX5APPTGESPPARGPPARAKDM4E
SCHEMBL3008051 0.88 KDM4E (0.39) ALOX5APPTGESPPARGPPARAKDM4E
SCHEMBL3006452 0.88 KDM4E (0.39) ALOX5APPTGESPPARGPPARAKDM4E
SCHEMBL3001004 0.88 KDM4E (0.39) ALOX5APPTGESPPARGPPARAKDM4E
SCHEMBL3000835 0.88 KMT2A (0.43) PTGESPPARGPPARAKDM4EL3MBTL1
SCHEMBL334166 0.87 PTGES (0.40) ALOX5APPTGESPPARGPPARAKDM4E

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 ALOX5AP 1106/4885PTGES 33/4885PPARG 2505/4885

“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.