SCHEMBL3359346

SCHEMBL3359346

CC(C)=CCCOC(=O)OCCC=C(C)C

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 4/20 0.52
ALDH1A1 P00352 4/20 0.45
KDM4E B2RXH2 1/20 0.40
ATM Q13315 1/20 0.40
POLB P06746 1/20 0.39
TSHR P16473 1/20 0.38
KMT2A Q03164 1/20 0.37

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
SCHEMBL5077225 0.88 ALOX15 (0.59) ALOX15ALDH1A1KDM4EATMKMT2A
SCHEMBL4740513 0.85 ALOX15 (0.68) ALOX15ALDH1A1KDM4EATMPOLB
SCHEMBL3359350 0.83 ALOX15 (0.50) ALOX15ALDH1A1KDM4EATMPOLB
SCHEMBL9541469 0.83 ALOX15 (0.50) ALOX15ALDH1A1KDM4EATMPOLB
SCHEMBL6951123 0.82 ALOX15 (0.80) ALOX15ALDH1A1TSHR
SCHEMBL16244314 0.81 ALOX15 (0.48) ALOX15ALDH1A1KDM4EATMPOLB
SCHEMBL6031146 0.81 ALOX15 (0.48) ALOX15ALDH1A1KDM4EATMPOLB
SCHEMBL13686652 0.78 BTN3A1 (0.49) ALOX15ALDH1A1KDM4EATMPOLB
SCHEMBL9260258 0.76 ALOX15 (0.71) ALOX15ALDH1A1TSHR
SCHEMBL6951114 0.76 ALOX15 (0.71) ALOX15ALDH1A1TSHR

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
EP-2781522-A1 OPTICALLY ACTIVE BISOXAZOLINE COMPOUND, ASYMMETRIC CATALYST, AND METHOD FOR PRODUCING OPTICALLY ACTIVE CYCLOPROPANE COMPOUND USING SAID CATALYST Sumitomo Chemical Company, Limited (JP) 2014-09-24 EP disclosed
US-7705165-B2 Method for producing optically active cyclopropanecarboxylate compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-04-27 US disclosed
US-7671210-B2 Process for production of optically active cyclopropanecarboxylate compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-03-02 US disclosed
US-20090048450-A1 Process for production of optically active cyclopropanecarboxylate compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-02-19 US disclosed
US-20080027235-A1 Method for Producing Optically Active Cyclopropanecarboxylate Compound SUMITOMO CHEMICAL COMPANY, LIMITED 2008-01-31 US disclosed
US-4667050-A Preparation of pyrethroid precursors THE DOW CHEMICAL COMPANY (US) 1987-05-19 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-20080027235-A1 Method for Producing Optically Active Cyclopropanecarboxylate Compound ACSL6, AOC1, CA6 ALOX15 593/4885ALDH1A1 1222/4885KDM4E 3833/4885
US-20090048450-A1 Process for production of optically active cyclopropanecarboxylate compound CBR3, C9, CBR1 ALOX15 1218/4885ALDH1A1 1594/4885KDM4E 2947/4885

“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.