SCHEMBL4223419

SCHEMBL4223419

CC1OC1CCCCC1CO1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.54
CHRM2 P08172 6/20 0.36
CHRM5 P08912 4/20 0.36
CHRM1 P11229 3/20 0.36
CHRM4 P08173 2/20 0.36
CHRM3 P20309 2/20 0.36
EPHX1 P07099 1/20 0.35
TSHR P16473 2/20 0.34
MAPK1 P28482 1/20 0.34
KDM4E B2RXH2 1/20 0.33
HTT P42858 1/20 0.33
SPHK1 Q9NYA1 4/20 0.32
SPHK2 Q9NRA0 3/20 0.32
TDP1 Q9NUW8 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL11349778 0.95 ALDH1A1 (0.48) ALDH1A1CHRM2CHRM5CHRM1CHRM4
SCHEMBL11270777 0.89 ALDH1A1 (0.43) ALDH1A1CHRM2CHRM5CHRM1CHRM4
SCHEMBL664256 0.85
SCHEMBL5694697 0.82 ALDH1A1 (0.43) ALDH1A1EPHX1KDM4ESPHK1SPHK2
SCHEMBL7511568 0.79 ALDH1A1 (0.68) ALDH1A1EPHX1TSHRMAPK1TDP1
SCHEMBL7517505 0.79 ALDH1A1 (0.68) ALDH1A1EPHX1TSHRMAPK1TDP1
SCHEMBL5340594 0.79 ALDH1A1 (0.68) ALDH1A1EPHX1TSHRMAPK1TDP1
SCHEMBL33715 0.79 ALDH1A1 (0.68) ALDH1A1EPHX1TSHRMAPK1TDP1
SCHEMBL7540476 0.76 ALDH1A1 (0.74) ALDH1A1EPHX1TSHRSPHK1SPHK2
SCHEMBL13865560 0.76 ALDH1A1 (0.74) ALDH1A1EPHX1TSHRSPHK1SPHK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1979336-B1 PROCESS FOR PRODUCING OF EPOXY COMPOUND SUMITOMO CHEMICAL CO (JP) 2013-04-17 EP disclosed
US-20090054670-A1 Process for Producing of Epoxy Compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-02-26 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 (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-20090054670-A1 Process for Producing of Epoxy Compound SQLE, SQOR, HMOX2 ALDH1A1 2376/4885CHRM2 2471/4885CHRM5 2820/4885

“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.