SCHEMBL17320925

SCHEMBL17320925

C=CC(=O)OCCOC(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.59
KIF11 P52732 1/20 0.47
TSHR P16473 7/20 0.47
ALDH1A1 P00352 6/20 0.47
TP53 P04637 3/20 0.47
HIF1A Q16665 3/20 0.47
HSD17B10 Q99714 1/20 0.47
CYP3A4 P08684 2/20 0.43
DUT P33316 1/20 0.43
HCAR2 Q8TDS4 1/20 0.41
HPGD P15428 1/20 0.40
SLC6A1 P30531 1/20 0.39
AKR1B10 O60218 2/20 0.39
AKR1B1 P15121 2/20 0.39
HRH4 Q9H3N8 1/20 0.38
HTT P42858 1/20 0.38
CYP2C9 P11712 1/20 0.36
ALOX15 P16050 1/20 0.36
CYP2C19 P33261 1/20 0.36
MAPK1 P28482 1/20 0.36

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
SCHEMBL10437472 0.84 THRB (0.56) THRBTSHRALDH1A1TP53HIF1A
SCHEMBL6537025 0.82 THRB (0.54) THRBTSHRALDH1A1TP53HIF1A
SCHEMBL9848771 0.82 THRB (0.54) THRBTSHRALDH1A1TP53HIF1A
SCHEMBL27853764 0.81 KIF11 (0.55) KIF11TSHRHIF1ADUTSLC6A1
SCHEMBL11702453 0.79 KIF11 (0.49) THRBKIF11TSHRALDH1A1CYP3A4
SCHEMBL4591972 0.79 THRB (0.50) THRBTSHRALDH1A1TP53HIF1A
SCHEMBL19393417 0.78 KIF11 (0.52) KIF11TSHRALDH1A1HIF1ADUT
SCHEMBL4591970 0.78 THRB (0.49) THRBTSHRALDH1A1TP53HIF1A
SCHEMBL14523011 0.77 THRB (0.48) THRBTSHRALDH1A1TP53HIF1A
SCHEMBL11275984 0.76 KIF11 (0.74) KIF11TSHRALDH1A1DUTSLC6A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10947393-B2 Coating agent NIPPON SODA CO., LTD. (JP) 2021-03-16 US disclosed
US-20150353738-A1 COATING AGENT NIPPON SODA CO., LTD. (JP) 2015-12-10 US disclosed
US-20150353738-A1 COATING AGENT NIPPON SODA CO., LTD. (JP) 2015-12-10 US 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 (2 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-20150353738-A1 COATING AGENT ITGA1, ITGA2, L1CAM THRB 3589/4885KIF11 3566/4885TSHR 3363/4885
US-10947393-B2 Coating agent ITGA1, ITGA2, L1CAM THRB 3589/4885KIF11 3566/4885TSHR 3363/4885

“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.