SCHEMBL7066779

SCHEMBL7066779

CNC(=O)C(Cc1ccc(OCc2cnc3ccc(OC)cc3c2OC(C)C)cc1)C(C)=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ICAM1 P05362 2/20 0.39
SELE P16581 2/20 0.39
MAPT P10636 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
THRB P10828 1/20 0.39
MTNR1A P48039 3/20 0.37
MTNR1B P49286 3/20 0.37
ALDH1A1 P00352 3/20 0.36
HPGD P15428 3/20 0.36
KDM4E B2RXH2 2/20 0.36
KMT2A Q03164 1/20 0.36
MMP1 P03956 2/20 0.35
OPRL1 P41146 1/20 0.35
EGFR P00533 1/20 0.35
ERBB2 P04626 1/20 0.35
CCR1 P32246 1/20 0.35
F2 P00734 1/20 0.35
GLA P06280 1/20 0.35
EDNRA P25101 1/20 0.35
LDHA P00338 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
SCHEMBL7066025 0.93 MAPT (0.40) ICAM1SELEMAPTSMN1; SMN2THRB
SCHEMBL7070060 0.91 MAPT (0.40) ICAM1SELEMAPTSMN1; SMN2THRB
SCHEMBL7066480 0.91 LDHA (0.42) ICAM1SELEMAPTSMN1; SMN2THRB
SCHEMBL7069283 0.89 ICAM1 (0.39) ICAM1SELEMAPTSMN1; SMN2THRB
SCHEMBL7071902 0.88 PPARG (0.43) ICAM1SELEMAPTSMN1; SMN2THRB
SCHEMBL7070398 0.88 MAPT (0.42) MAPTSMN1; SMN2THRBALDH1A1HPGD
Hydrochloric Acid SCHEMBL7066556 0.87 PPARG (0.42) ICAM1SELEMAPTSMN1; SMN2THRB
SCHEMBL7069467 0.85 MAPT (0.39) ICAM1SELEMAPTSMN1; SMN2THRB
SCHEMBL7070604 0.85 MAPT (0.44) MAPTSMN1; SMN2THRBALDH1A1HPGD
SCHEMBL7072767 0.84 MAPT (0.41) ICAM1SELEMAPTSMN1; SMN2THRB

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 ICAM1 4147/4885SELE 4747/4885MAPT 2433/4885

“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.