SCHEMBL3757845

SCHEMBL3757845

CCC(CC(C)C)CC(C)C(C)C

nearest known ligand 0.30

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.30
TSHR P16473 1/20 0.30
MAPK1 P28482 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
SCHEMBL18469125 0.85 ALDH1A1 (0.35) ALDH1A1TSHRMAPK1
SCHEMBL4652961 0.85 TSHR (0.39) ALDH1A1TSHRMAPK1
SCHEMBL4654352 0.81
SCHEMBL597708 0.78
SCHEMBL6766875 0.76 ALDH1A1 (0.32) ALDH1A1TSHR
SCHEMBL10263274 0.76 TRPA1 (0.45) ALDH1A1TSHR
SCHEMBL582191 0.75
SCHEMBL22096778 0.74 ALDH1A1 (0.40) ALDH1A1TSHR
SCHEMBL17628559 0.73 TSHR (0.35) ALDH1A1TSHRMAPK1
SCHEMBL24517662 0.72 RNPEP (0.33) ALDH1A1TSHRMAPK1

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
EP-2006315-B1 CATALYST FOR PRODUCING POLYESTER AND METHOD FOR PRODUCING POLYESTER TORAY INDUSTRIES (JP) 2017-11-08 EP disclosed
US-8779082-B2 Catalyst for producing polyester and method for producing polyester TORAY INDUSTRIES, INC. (JP) 2014-07-15 US disclosed
US-20100305296-A1 Catalyst for Producing Polyester and Method for Producing Polyester TORAY INDUSTRIES INC. (JP) 2010-12-02 US disclosed
EP-2006315-A1 CATALYST FOR PRODUCING POLYESTER AND METHOD FOR PRODUCING POLYESTER TORAY INDUSTRIES, INC. (JP) 2008-12-24 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-20100305296-A1 Catalyst for Producing Polyester and Method for Producing Polyester AQP4, PNMT, NEFM ALDH1A1 1584/4885TSHR 3845/4885MAPK1 2952/4885

“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.