SCHEMBL7070063

SCHEMBL7070063

COC(=O)C(Cc1ccccc1OCc1cnc2ccc(OC)cc2c1OC(C)C)C(C)=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
THRB P10828 1/20 0.40
ALDH1A1 P00352 3/20 0.39
HPGD P15428 3/20 0.39
LMNA P02545 2/20 0.39
GAA P10253 1/20 0.39
RAB9A P51151 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
MTNR1B P49286 7/20 0.38
MTNR1A P48039 6/20 0.38
KDM4E B2RXH2 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
SGMS2 Q8NHU3 1/20 0.37
TP53 P04637 2/20 0.36
ICAM1 P05362 1/20 0.35
SELE P16581 1/20 0.35
DDR2 Q16832 1/20 0.35
PLK1 P53350 1/20 0.34
F2 P00734 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
SCHEMBL7066027 0.95 MAPT (0.41) MAPTSMN1; SMN2THRBALDH1A1HPGD
SCHEMBL7070400 0.93 MAPT (0.43) MAPTSMN1; SMN2THRBALDH1A1HPGD
SCHEMBL7066492 0.93 MAPT (0.38) MAPTSMN1; SMN2THRBALDH1A1HPGD
SCHEMBL7072769 0.92 MAPT (0.41) MAPTSMN1; SMN2THRBALDH1A1HPGD
SCHEMBL7069288 0.91 ICAM1 (0.38) MAPTSMN1; SMN2THRBALDH1A1HPGD
Hydrochloric Acid SCHEMBL7069683 0.91 MAPT (0.41) MAPTSMN1; SMN2THRBALDH1A1HPGD
SCHEMBL7598993 0.90 MAPT (0.39) MAPTSMN1; SMN2THRBALDH1A1HPGD
Hydrochloric Acid SCHEMBL7597575 0.89 MAPT (0.39) MAPTSMN1; SMN2THRBALDH1A1HPGD
SCHEMBL7069471 0.88 MAPT (0.40) MAPTSMN1; SMN2THRBALDH1A1HPGD
SCHEMBL7066551 0.87 MAPT (0.40) MAPTSMN1; SMN2THRBALDH1A1HPGD

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 MAPT 2433/4885SMN1; SMN2 3691/4885THRB 956/4885

“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.