SCHEMBL10099508

SCHEMBL10099508

C=CC(=O)OCCOC1CSCCO1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.43
ALDH1A1 P00352 4/20 0.43
TP53 P04637 3/20 0.43
HIF1A Q16665 3/20 0.43
HSD17B10 Q99714 1/20 0.43
CYP3A4 P08684 2/20 0.40
THRB P10828 2/20 0.38
HPGD P15428 1/20 0.37
MAPK1 P28482 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL12093599 0.87 ALDH1A1 (0.34) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL10099499 0.83 TSHR (0.36) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL29419635 0.83 TSHR (0.50) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL10099502 0.81 TSHR (0.41) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL10099507 0.80 TSHR (0.43) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL775364 0.80 ALDH1A1 (0.32) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL775366 0.80
SCHEMBL21059523 0.79 TSHR (0.53) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL3909857 0.79 TSHR (0.46) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL11883906 0.78 TSHR (0.44) TSHRALDH1A1TP53HIF1AHSD17B10

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-9260407-B2 Salt and photoresist composition comprising the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-02-16 US disclosed
US-8753795-B2 Photoresist composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-06-17 US disclosed
US-20120251945-A1 PHOTORESIST COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-10-04 US disclosed
US-20120122032-A1 SALT AND PHOTORESIST COMPOSITION COMPRISING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-05-17 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-20120251945-A1 PHOTORESIST COMPOSITION H1-0, COL1A1, REV1 TSHR 2932/4885ALDH1A1 524/4885TP53 804/4885
US-20120122032-A1 SALT AND PHOTORESIST COMPOSITION COMPRISING THE SAME RER1, RCOR1, PNISR TSHR 516/4885ALDH1A1 2944/4885TP53 4271/4885

“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.