SCHEMBL7070607

SCHEMBL7070607

COc1ccc2ncc(COc3ccc(CC(Sc4ccc(Cl)cc4)C(=O)O)cc3)c(OC(C)C)c2c1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGES O14684 1/20 0.38
PPARG P37231 4/20 0.37
PPARA Q07869 2/20 0.37
ALOX5 P09917 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
MAPT P10636 1/20 0.37
THRB P10828 1/20 0.37
MAOB P27338 2/20 0.37
PPARD Q03181 1/20 0.36
KMT2A Q03164 2/20 0.35
KDM4E B2RXH2 1/20 0.35
NMT1 P30419 1/20 0.34
EDNRA P25101 1/20 0.34
KCNH2 Q12809 1/20 0.34
RECQL P46063 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
SCHEMBL7070611 0.88 PPARG (0.38) PTGESPPARGPPARAALOX5SMN1; SMN2
SCHEMBL7067720 0.87 PPARA (0.50) PPARGPPARAPPARD
SCHEMBL7066480 0.82 LDHA (0.42) SMN1; SMN2MAPTTHRBMAOBKDM4E
SCHEMBL7069475 0.82 PPARG (0.36) PTGESPPARGPPARAALOX5SMN1; SMN2
SCHEMBL7066025 0.82 MAPT (0.40) SMN1; SMN2MAPTTHRBMAOBKDM4E
SCHEMBL7072705 0.82 KDM4E (0.41) SMN1; SMN2MAPTTHRBKMT2AKDM4E
SCHEMBL7069531 0.81 LDHA (0.40) PPARGPPARASMN1; SMN2MAPTTHRB
SCHEMBL7067668 0.80 PPARA (0.53) PPARGPPARAPPARD
SCHEMBL7066505 0.80 PPARG (0.53) PPARGPPARA
SCHEMBL7071902 0.79 PPARG (0.43) PPARGPPARASMN1; SMN2MAPTTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030212100-A1 Quinoline derivatives and medicinal use thereof MITSUI CHEMICALS, INC. (JP) 2003-11-13 US disclosed
EP-1266888-A1 QUINOLINE DERIVATIVES AND MEDICINAL USE THEREOF Mitsui Chemicals, Inc. (JP) 2002-12-18 EP 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-20030212100-A1 Quinoline derivatives and medicinal use thereof PPARG, PPARD, PPARA PTGES 609/4885PPARG 1/4885PPARA 3/4885

“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.