SCHEMBL12475680

SCHEMBL12475680

COc1ccc(C(C)(O)c2ccsc2)c(OC)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA7 P43166 1/20 0.40
CA9 Q16790 1/20 0.40
CA14 Q9ULX7 1/20 0.40
PDGFRB P09619 3/20 0.39
PDGFRA P16234 3/20 0.39
NPC1 O15118 1/20 0.38
SIK1 P57059 1/20 0.37
SIK2 Q9H0K1 1/20 0.37
SIK3 Q9Y2K2 1/20 0.37
ALDH1A1 P00352 5/20 0.37
HPGD P15428 3/20 0.37
CYP3A4 P08684 2/20 0.37
MAPT P10636 2/20 0.37
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
TP53 P04637 1/20 0.37
MAPK1 P28482 1/20 0.37

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
Fenocinol SCHEMBL2110781 0.79 CA12 (0.44) CA12CA1CA2CA7CA9
SCHEMBL15164794 0.78 CA12 (0.56) CA12CA1CA2CA7CA9
SCHEMBL28076976 0.77 NPC1 (0.45) CA12CA1CA2CA7CA9
SCHEMBL28076977 0.77 NPC1 (0.45) CA12CA1CA2CA7CA9
SCHEMBL9115762 0.74 CA12 (0.54) CA12CA1CA2CA7CA9
SCHEMBL12475728 0.74 KMT2A (0.48) CA12CA1CA2CA7CA9
SCHEMBL29539579 0.72 CA12 (0.56) CA12CA1CA2CA7CA9
SCHEMBL35743 0.72 CA12 (0.56) CA12CA1CA2CA7CA9
SCHEMBL12475392 0.72 CASR (0.40) CA12CA1CA2CA7CA9
SCHEMBL17286726 0.72 CA12 (0.47) CA12CA1CA2CA7CA9

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 CA12 3147/4885CA1 4268/4885CA2 3305/4885

“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.