SCHEMBL5652374

SCHEMBL5652374

C=CC(=O)OCCc1cc[c]cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.50
ALDH1A1 P00352 4/20 0.50
THRB P10828 4/20 0.50
TP53 P04637 3/20 0.50
HIF1A Q16665 3/20 0.50
HSD17B10 Q99714 3/20 0.50
HCAR2 Q8TDS4 1/20 0.46
CYP3A4 P08684 3/20 0.46
AKR1B10 O60218 4/20 0.44
AKR1B1 P15121 4/20 0.44
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
MET P08581 1/20 0.43
CA4 P22748 1/20 0.43
CA6 P23280 1/20 0.43
CA5A P35218 1/20 0.43
CA7 P43166 1/20 0.43
CA9 Q16790 1/20 0.43
CA14 Q9ULX7 1/20 0.43
CA5B Q9Y2D0 1/20 0.43

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
SCHEMBL28160997 0.90 TSHR (0.52) TSHRALDH1A1THRBTP53HIF1A
SCHEMBL9806249 0.87 TSHR (0.59) TSHRALDH1A1THRBTP53HIF1A
SCHEMBL9761713 0.82 TSHR (0.53) TSHRALDH1A1THRBTP53HIF1A
SCHEMBL40718 0.82 THRB (0.67) TSHRALDH1A1THRBTP53HIF1A
SCHEMBL10353338 0.82 HCAR2 (0.43) TSHRALDH1A1THRBTP53HIF1A
SCHEMBL17914469 0.82 TSHR (0.53) TSHRALDH1A1THRBTP53HIF1A
SCHEMBL12032270 0.82 TSHR (0.53) TSHRALDH1A1THRBTP53HIF1A
SCHEMBL5040437 0.81 THRB (0.71) TSHRALDH1A1THRBTP53HIF1A
SCHEMBL27630823 0.81 THRB (0.49) TSHRALDH1A1THRBTP53HIF1A
SCHEMBL969345 0.81 MET (0.64) TSHRALDH1A1THRBTP53HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070207331-A1 Azo compounds and coating compositions containing the azo compounds EASTMAN CHEMICAL COMPANY 2007-09-06 US disclosed
CN-1311987-C Recording medium excellent in light-resistance and method for production thereof MITSUI CHEMICALSINC (JP) 2007-04-25 CN disclosed
CN-1555317-A Recording medium excellent in light-resistance and method for production thereof ������ѧ��ʽ���� 2004-12-15 CN disclosed
CN-1402741-A Soft contact lens JOHNSON & JOHNSON VISION CARE (US) 2003-03-12 CN 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-20070207331-A1 Azo compounds and coating compositions containing the azo compounds EED, RARG, MLLT1 TSHR 4853/4885ALDH1A1 479/4885THRB 4671/4885

“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.