SCHEMBL3708709

SCHEMBL3708709

OC1(C2(O)CCCCCCCC2)CCCCCCCC1

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.42
TSHR P16473 2/20 0.32
CYP2C19 P33261 1/20 0.32
USP2 O75604 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
SCHEMBL11039676 1.00 ALDH1A1 (0.42) ALDH1A1TSHRCYP2C19USP2
SCHEMBL226936 1.00 ALDH1A1 (0.42) ALDH1A1TSHRCYP2C19USP2
SCHEMBL4004633 1.00 ALDH1A1 (0.42) ALDH1A1TSHRCYP2C19USP2
SCHEMBL3708731 1.00 ALDH1A1 (0.42) ALDH1A1TSHRCYP2C19USP2
SCHEMBL6048331 1.00 ALDH1A1 (0.42) ALDH1A1TSHRCYP2C19USP2
SCHEMBL535863 1.00 ALDH1A1 (0.42) ALDH1A1TSHRCYP2C19USP2
SCHEMBL8732941 1.00 ALDH1A1 (0.42) ALDH1A1TSHRCYP2C19USP2
SCHEMBL11423768 1.00 ALDH1A1 (0.42) ALDH1A1TSHRCYP2C19USP2
SCHEMBL18249750 0.96 ALDH1A1 (0.40) ALDH1A1TSHRCYP2C19
SCHEMBL4612532 0.95 ALDH1A1 (0.37) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11267953-B2 Iso(thio)cyanate composition, and resin composition including same for optical member HOYA LENS THAILAND LTD. (TH) 2022-03-08 US disclosed
EP-3957666-A1 ISO(THIO)CYANATE COMPOSITION, AND RESIN COMPOSITION INCLUDING SAME FOR OPTICAL MEMBER Hoya Lens Thailand Ltd. (TH) 2022-02-23 EP disclosed
EP-3269749-B1 ISO(THIO)CYANATE COMPOSITION, AND RESIN COMPOSITION INCLUDING SAME FOR OPTICAL MEMBER HOYA LENS THAILAND LTD (TH) 2021-12-01 EP disclosed
US-20200123345-A1 ISO(THIO)CYANATE COMPOSITION, AND RESIN COMPOSITION INCLUDING SAME FOR OPTICAL MEMBER HOYA LENS THAILAND LTD. (TH) 2020-04-23 US disclosed
US-10544283-B2 Iso(thio)cyanate composition, and resin composition including same for optical member HOYA LENS THAILAND LTD. (TH) 2020-01-28 US disclosed
US-20180037722-A1 ISO(THIO)CYANATE COMPOSITION, AND RESIN COMPOSITION INCLUDING SAME FOR OPTICAL MEMBER HOYA LENS THAILAND LTD. (TH) 2018-02-08 US disclosed
EP-3269749-A1 ISO(THIO)CYANATE COMPOSITION, AND RESIN COMPOSITION INCLUDING SAME FOR OPTICAL MEMBER Hoya Lens Thailand Ltd. (TH) 2018-01-17 EP disclosed
US-20120190811-A1 PROCESS FOR THE PREPARATION OF AN ALLYL ALKYL ETHER BY CATALYTIC ALLYLATION HEXION INC. (FORMERLY KNOWN AS MOMENTIVE SPECIALTY CHEMICALS INC.) 2012-07-26 US disclosed
EP-2393767-A1 PROCESS FOR THE PREPARATION OF AN ALLY ALKYL EHTER BY CATALYTIC ALLYATION Momentive Specialty Chemicals Research Belgium S.A. (BE) 2011-12-14 EP disclosed
WO-2010086139-A1 PROCESS FOR THE PREPARATION OF AN ALLY ALKYL EHTER BY CATALYTIC ALLYATION RESOLUTION RESEARCH NEDERLAND B.V. (NL) 2010-08-05 WO disclosed
EP-2213644-A1 Process for the preparation of an allyl alkyl ether by catalyic allylation Hexion Specialty Chemicals Research Belgium S.A. (BE) 2010-08-04 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-20120190811-A1 PROCESS FOR THE PREPARATION OF AN ALLYL ALKYL ETHER BY CATALYTIC ALLYLATION ALOX5, APEH, ALKBH5 ALDH1A1 568/4885TSHR 3478/4885CYP2C19 497/4885

“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.