SCHEMBL2721176

SCHEMBL2721176

CC(C)(C)c1cc(C2C=CC(c3ccc(O)cc3)C=C2)ccc1O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.58
ALOX15 P16050 4/20 0.58
LMNA P02545 3/20 0.58
TYR P14679 2/20 0.58
HSD17B10 Q99714 2/20 0.58
NR1I2 O75469 1/20 0.58
CYP2C9 P11712 1/20 0.58
MIF P14174 1/20 0.58
HTT P42858 1/20 0.58
NFE2L2 Q16236 1/20 0.58
GAA P10253 1/20 0.44
KDM4E B2RXH2 1/20 0.42
CYP1A2 P05177 1/20 0.42
MAPT P10636 1/20 0.42
ATP2A2 P16615 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
ATP2A3 Q93084 1/20 0.42
TDP1 Q9NUW8 2/20 0.38
TSHR P16473 1/20 0.38
ESR1 P03372 1/20 0.38

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
SCHEMBL2720142 0.84 ALDH1A1 (0.40) ALDH1A1ALOX15LMNATYRHSD17B10
SCHEMBL2718720 0.83 SHBG (0.45) ALDH1A1ALOX15LMNATYRHSD17B10
SCHEMBL4218511 0.78 CNR2 (0.38) ESR1ESR2
SCHEMBL3807478 0.78 CYP2C9 (0.56) ALDH1A1ALOX15LMNATYRHSD17B10
SCHEMBL3809639 0.78 CYP2C9 (0.56) ALDH1A1ALOX15LMNATYRHSD17B10
SCHEMBL2718010 0.78 CYP2C9 (0.56) ALDH1A1ALOX15LMNATYRHSD17B10
E319 SCHEMBL10625736 0.77 ALDH1A1 (0.95) ALDH1A1ALOX15LMNATYRHSD17B10
SCHEMBL2836319 0.77 ESR1 (0.44) ALDH1A1ALOX15HSD17B10CYP2C9GAA
E319 SCHEMBL26745 0.75 ALDH1A1 (1.00) ALDH1A1ALOX15LMNATYRHSD17B10
E319 SCHEMBL29350903 0.75 ALDH1A1 (1.00) ALDH1A1ALOX15LMNATYRHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1995245-B1 METHOD FOR PRODUCING EPOXY COMPOUND SUMITOMO CHEMICAL CO (JP) 2012-05-02 EP disclosed
US-20090054669-A1 Process For Producing Epoxy Compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-02-26 US disclosed
EP-1995245-A1 METHOD FOR PRODUCING EPOXY COMPOUND Sumitomo Chemical Company, Limited (JP) 2008-11-26 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-20090054669-A1 Process For Producing Epoxy Compound RER1, AR, CYP1A1 ALDH1A1 464/4885ALOX15 411/4885LMNA 3122/4885

“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.