SCHEMBL4227447

SCHEMBL4227447

CCC(C)c1cc(C2C=CC(c3ccc(O)cc3)CC2)ccc1O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RORC P51449 1/20 0.44
TSHR P16473 1/20 0.40
ALOX15 P16050 2/20 0.36
USP2 O75604 1/20 0.36
ALDH1A1 P00352 1/20 0.36
GAA P10253 1/20 0.36
PKM P14618 1/20 0.36
HPGD P15428 1/20 0.36
HSD17B10 Q99714 1/20 0.36
ESR2 Q92731 6/20 0.33
ESR1 P03372 5/20 0.32
CYP3A4 P08684 2/20 0.32
CYP2C9 P11712 2/20 0.32
DRD1 P21728 2/20 0.32
DRD3 P35462 2/20 0.32
LMNA P02545 1/20 0.32
CYP1A2 P05177 1/20 0.32
PGR P06401 1/20 0.32
CHRM2 P08172 1/20 0.32
ADORA3 P0DMS8 1/20 0.32

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
SCHEMBL2721520 0.88 RORC (0.34) RORCESR2ESR1DRD1DRD3
SCHEMBL4215607 0.87 HSP90AA1 (0.36) ALDH1A1GAAESR2LMNACHRM1
SCHEMBL2717120 0.84 ESR1 (0.35) ESR2ESR1DRD1DRD3DRD2
SCHEMBL2717931 0.82 ESR2 (0.49) RORCTSHRESR2ESR1CYP3A4
SCHEMBL2722166 0.81 RORC (0.47) RORCTSHRALOX15USP2ALDH1A1
SCHEMBL2718702 0.78 ESR2 (0.40) ALDH1A1GAAESR2ESR1
SCHEMBL4223410 0.75 ESR2 (0.39) TSHRALOX15ESR2ESR1CYP3A4
SCHEMBL2718567 0.75 ESR2 (0.41) ALDH1A1GAAESR2ESR1AR
SCHEMBL2717610 0.75 RORC (0.37) RORCTSHRALOX15USP2ALDH1A1
SCHEMBL22471698 0.75 ACMSD (0.49) RORCTSHRALOX15USP2ALDH1A1

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
CN-101400665-A Method for producing epoxy compound SUMITOMO CHEMICAL CO (JP) 2009-04-01 CN disclosed
US-20090054669-A1 Process For Producing 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-20090054669-A1 Process For Producing Epoxy Compound RER1, AR, CYP1A1 RORC 1853/4885TSHR 2772/4885ALOX15 411/4885

“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.