SCHEMBL12475728

SCHEMBL12475728

COc1ccc(C(C)(O)c2cccs2)c(OC)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.48
MEN1 O00255 5/20 0.48
MAPT P10636 4/20 0.48
KDM4E B2RXH2 4/20 0.48
CYP3A4 P08684 3/20 0.48
ALDH1A1 P00352 3/20 0.48
HPGD P15428 2/20 0.48
TP53 P04637 1/20 0.48
MAPK1 P28482 1/20 0.48
CASP1 P29466 1/20 0.48
BRCA1 P38398 1/20 0.48
RECQL P46063 1/20 0.48
CASP7 P55210 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
CYP2C19 P33261 1/20 0.42
USP2 O75604 1/20 0.41
POLB P06746 4/20 0.40
SMN1; SMN2 Q16637 4/20 0.40
NPSR1 Q6W5P4 1/20 0.40
CTDSP1 Q9GZU7 1/20 0.40

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
SCHEMBL17340388 0.80 ALOX5 (0.37) KMT2AMEN1MAPTKDM4ECYP3A4
SCHEMBL12475656 0.80 POLB (0.42) KMT2AMEN1MAPTKDM4ECYP3A4
SCHEMBL12475318 0.79 USP2 (0.42) KMT2AMEN1MAPTKDM4ECYP3A4
Fenocinol SCHEMBL2110781 0.76 CA12 (0.44) KMT2AMEN1MAPTCYP3A4ALDH1A1
SCHEMBL12475392 0.75 CASR (0.40) KMT2AMEN1MAPTKDM4ECYP3A4
SCHEMBL9115762 0.74 CA12 (0.54) KMT2AMEN1MAPTKDM4ECYP3A4
SCHEMBL12475680 0.74 CA12 (0.40) KMT2AMEN1MAPTKDM4ECYP3A4
SCHEMBL29539579 0.72 CA12 (0.56) KMT2AMEN1MAPTKDM4ECYP3A4
SCHEMBL35743 0.72 CA12 (0.56) KMT2AMEN1MAPTKDM4ECYP3A4
SCHEMBL29280648 0.72 SMN1; SMN2 (0.47) KMT2AMEN1MAPTKDM4ECYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9422261-B2 Heterocyclic resorcinol derivatives, preparation of same and cosmetic uses thereof PIERRE FABRE DERMO-COSMETIQUE (FR) 2016-08-23 US disclosed
US-9422261-B2 Heterocyclic resorcinol derivatives, preparation of same and cosmetic uses thereof PIERRE FABRE DERMO-COSMETIQUE (FR) 2016-08-23 US disclosed
US-9422261-B2 Heterocyclic resorcinol derivatives, preparation of same and cosmetic uses thereof PIERRE FABRE DERMO-COSMETIQUE (FR) 2016-08-23 US disclosed
EP-2673261-B1 HETEROCYCLIC RESORCINOL DERIVATIVES, PREPARATION OF SAME AND COSMETIC USES THEREOF PIERRE FABRE DERMO COSMÉTIQUE (FR) 2015-12-16 EP disclosed
EP-2673261-B1 HETEROCYCLIC RESORCINOL DERIVATIVES, PREPARATION OF SAME AND COSMETIC USES THEREOF PIERRE FABRE DERMO COSMÉTIQUE (FR) 2015-12-16 EP disclosed
US-20140050683-A1 HETEROCYCLIC RESORCINOL DERIVATIVES, PREPARATION OF SAME AND COSMETIC USES THEREOF PIERRE FABRE DERMO-COSMETIQUE (FR) 2014-02-20 US disclosed
US-20140050683-A1 HETEROCYCLIC RESORCINOL DERIVATIVES, PREPARATION OF SAME AND COSMETIC USES THEREOF PIERRE FABRE DERMO-COSMETIQUE (FR) 2014-02-20 US disclosed
US-20140050683-A1 HETEROCYCLIC RESORCINOL DERIVATIVES, PREPARATION OF SAME AND COSMETIC USES THEREOF PIERRE FABRE DERMO-COSMETIQUE (FR) 2014-02-20 US disclosed
EP-2673261-A1 HETEROCYCLIC RESORCINOL DERIVATIVES, PREPARATION OF SAME AND COSMETIC USES THEREOF Pierre Fabre Dermo-Cosmétique (FR) 2013-12-18 EP disclosed
WO-2012107421-A1 HETEROCYCLIC RESORCINOL DERIVATIVES, PREPARATION OF SAME AND COSMETIC USES THEREOF PIERRE FABRE DERMO-COSMETIQUE (FR) 2012-08-16 WO 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-20140050683-A1 HETEROCYCLIC RESORCINOL DERIVATIVES, PREPARATION OF SAME AND COSMETIC USES THEREOF NQO1, SQOR, CBR1 KMT2A 1968/4885MEN1 531/4885MAPT 3543/4885

“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.