SCHEMBL4223417

SCHEMBL4223417

CC1OC1C.CCCC1CO1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.52
CHRM2 P08172 8/20 0.43
CHRM5 P08912 6/20 0.43
CHRM3 P20309 4/20 0.43
CHRM1 P11229 3/20 0.43
CHRM4 P08173 3/20 0.43
TSHR P16473 1/20 0.37
MAPK1 P28482 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
KDM4E B2RXH2 1/20 0.35
HTT P42858 1/20 0.35
TDP1 Q9NUW8 2/20 0.34
EPHX1 P07099 1/20 0.33
PRKD3 O94806 2/20 0.31
PRKCG P05129 2/20 0.31
PRKCB P05771 2/20 0.31
PRKCA P17252 2/20 0.31
PRKCH P24723 2/20 0.31
PRKCI P41743 2/20 0.31
PRKCE Q02156 2/20 0.31

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
SCHEMBL5152467 0.89
SCHEMBL45142 0.89
SCHEMBL3841502 0.89
SCHEMBL18279951 0.89 ALDH1A1 (0.62) ALDH1A1CHRM2CHRM5CHRM3CHRM1
Propylene Oxide SCHEMBL3619770 0.86 ALDH1A1 (0.54) ALDH1A1CHRM2CHRM5CHRM3CHRM1
SCHEMBL28283561 0.86 ALDH1A1 (0.59) ALDH1A1CHRM2CHRM5CHRM3CHRM1
Hydroxyl Radical SCHEMBL28244610 0.86
Methyl Alcohol SCHEMBL4464000 0.83
Methoxymethane SCHEMBL6931778 0.81
Oxirane SCHEMBL27656054 0.81

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.