SCHEMBL15675992

SCHEMBL15675992

CCCC(c1cc(C)c(O)cc1C)(c1cc(C)c(O)cc1C)c1cc(C)c(O)cc1C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 18/20 0.48
ESR2 Q92731 4/20 0.48
AR P10275 2/20 0.48
CYP2D6 P10635 2/20 0.41
CYP2C9 P11712 2/20 0.41
ALOX15 P16050 2/20 0.41
CYP2C19 P33261 2/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
MAPT P10636 1/20 0.41
G6PD P11413 1/20 0.41
PKM P14618 1/20 0.41
HPGD P15428 1/20 0.41
ALOX12 P18054 1/20 0.41
MAPK1 P28482 1/20 0.41
CCR6 P51684 1/20 0.41
HIF1A Q16665 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41

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
SCHEMBL7861330 0.83 ESR1 (0.45) ESR1ESR2ARCYP2D6CYP2C9
SCHEMBL29498346 0.83 ALOX15 (0.53) ESR1ESR2ARCYP2D6CYP2C9
SCHEMBL225503 0.83 ALOX15 (0.53) ESR1ESR2ARCYP2D6CYP2C9
Butylated Hydroxytoluene SCHEMBL8487462 0.76 ALDH1A1 (0.53) ESR1ESR2ARCYP2D6CYP2C9
SCHEMBL28255701 0.75 KDM4E (0.40) ESR1ESR2ARCYP2D6CYP2C9
SCHEMBL8861301 0.74 ESR1 (0.47) ESR1ESR2ARCYP2D6CYP2C9
SCHEMBL9853953 0.74 CNR1 (0.39) ESR1ESR2AR
SCHEMBL3434639 0.73 ESR1 (0.44) ESR1ESR2ARCYP2D6CYP2C9
SCHEMBL375159 0.72 ESR1 (0.42) ESR1ESR2ARCYP2D6CYP2C9
SCHEMBL29872696 0.72 ALOX15 (0.52) ESR1ESR2CYP2D6CYP2C9ALOX15

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
US-9256126-B2 Methanofullerenes IRRESISTIBLE MATERIALS LTD (GB) 2016-02-09 US disclosed
US-20140134843-A1 Methanofullerenes IRRESISTIBLE MATERIALS LTD (GB) 2014-05-15 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-20140134843-A1 Methanofullerenes WASF2, ERCC4, TUFM ESR1 1036/4885ESR2 1065/4885AR 1991/4885

“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.