SCHEMBL4155564

SCHEMBL4155564

C=CC(=O)OCC1CC2OC2CC1C

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.36
HPGD P15428 1/20 0.35
ALDH1A1 P00352 4/20 0.34
TP53 P04637 3/20 0.34
HIF1A Q16665 3/20 0.34
CYP3A4 P08684 2/20 0.34
HSD17B10 Q99714 1/20 0.34
MAPK1 P28482 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
THRB P10828 2/20 0.30
PPP5C P53041 1/20 0.30

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
SCHEMBL10150647 0.88 TSHR (0.44) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL8660631 0.87 PPP5C (0.32) ALDH1A1SMN1; SMN2THRBPPP5C
SCHEMBL8660632 0.87 PPP5C (0.32) ALDH1A1SMN1; SMN2THRBPPP5C
SCHEMBL23494077 0.82 TSHR (0.39) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL11764057 0.82 PPP5C (0.34) PPP5C
SCHEMBL31375709 0.82 PPP5C (0.34) ALDH1A1PPP5C
SCHEMBL4624809 0.80 NLRP3 (0.34) TSHRALDH1A1HIF1AHSD17B10SMN1; SMN2
SCHEMBL12881657 0.79 MGAM (0.33) PPP5C
SCHEMBL259361 0.79 LMNA (0.34) TSHRALDH1A1PPP5C
SCHEMBL14276054 0.78 TSHR (0.39) TSHRHPGDALDH1A1TP53HIF1A

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
CN-111154058-B Flame-retardant polymer polyol and preparation method and application thereof 万华化学集团股份有限公司 2021-10-22 CN claimed
CN-111154058-A Flame-retardant polymer polyol and preparation method and application thereof 万华化学集团股份有限公司 2020-05-15 CN claimed
CN-111154058-B Flame-retardant polymer polyol and preparation method and application thereof 万华化学集团股份有限公司 2021-10-22 CN disclosed
CN-111154058-A Flame-retardant polymer polyol and preparation method and application thereof 万华化学集团股份有限公司 2020-05-15 CN disclosed
US-20090124776-A1 Cycloaliphatic epoxy (meth)acrylates, preparation processes thereof, and copolymers DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2009-05-14 US disclosed
EP-1818327-A1 ALICYCLIC EPOXY (METH)ACRYLATES, PROCESS FOR PRODUCTION THEREOF, AND COPOLYMERS Daicel Chemical Industries, Ltd. (JP) 2007-08-15 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-20090124776-A1 Cycloaliphatic epoxy (meth)acrylates, preparation processes thereof, and copolymers MEP1B, MEP1A, ACMSD TSHR 3947/4885HPGD 1102/4885ALDH1A1 1902/4885

“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.