SCHEMBL3100680

SCHEMBL3100680

C=COCCCCOCc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.50
L3MBTL1 Q9Y468 2/20 0.47
TDP1 Q9NUW8 1/20 0.47
TEAD3 Q99594 2/20 0.47
HRH4 Q9H3N8 1/20 0.43
HRH3 Q9Y5N1 1/20 0.43
NAAA Q02083 3/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA7 P43166 1/20 0.40
CA9 Q16790 1/20 0.40
GBA1 P04062 2/20 0.39
UGCG Q16739 2/20 0.39
GBA2 Q9HCG7 2/20 0.39
EPHX2 P34913 1/20 0.39
LTA4H P09960 1/20 0.38

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
SCHEMBL13096843 0.98 L3MBTL1 (0.50) TSHRL3MBTL1TDP1TEAD3HRH4
SCHEMBL2971583 0.89 TSHR (0.54) TSHRL3MBTL1TDP1TEAD3HRH4
SCHEMBL7739984 0.87 TSHR (0.52) TSHRL3MBTL1TDP1TEAD3HRH4
SCHEMBL2640223 0.84 TSHR (0.70) TSHRL3MBTL1TDP1HRH4HRH3
SCHEMBL14076881 0.82 ALDH1A1 (0.38) TSHRL3MBTL1TDP1TEAD3HRH4
SCHEMBL9011734 0.82 TSHR (0.67) TSHRL3MBTL1TDP1HRH4HRH3
SCHEMBL9011624 0.82 TSHR (0.67) TSHRL3MBTL1TDP1HRH4HRH3
SCHEMBL9011595 0.82 TSHR (0.67) TSHRL3MBTL1TDP1HRH4HRH3
SCHEMBL9011715 0.82 TSHR (0.67) TSHRL3MBTL1TDP1HRH4HRH3
SCHEMBL9011646 0.82 TSHR (0.67) TSHRL3MBTL1TDP1HRH4HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025137605-A1 COMPOUNDS FOR TARGETED DEGRADATION OF PROTO-ONCOGENE TYROSINE PROTEIN KINASE RECEPTOR C4 THERAPEUTICS, INC. (US) 2025-06-26 WO disclosed
US-8367702-B2 Quinolone derivative ASTELLAS PHARMA INC. (JP) 2013-02-05 US disclosed
US-8367702-B2 Quinolone derivative ASTELLAS PHARMA INC. (JP) 2013-02-05 US disclosed
US-20100256113-A1 QUINOLONE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2010-10-07 US disclosed
US-20100256113-A1 QUINOLONE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2010-10-07 US disclosed
EP-2194044-A1 QUINOLONE DERIVATIVE Astellas Pharma Inc. (JP) 2010-06-09 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-20100256113-A1 QUINOLONE DERIVATIVE NQO1, NQO2, NADK TSHR 4536/4885L3MBTL1 2056/4885TDP1 3099/4885

“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.