SCHEMBL9969790

SCHEMBL9969790

O=C1CC(Cc2ccc(O)cc2O)C(=O)N1CCCN1C(=O)CC(Cc2ccc(O)cc2O)C1=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.42
KDM4E B2RXH2 1/20 0.42
TSHR P16473 4/20 0.40
L3MBTL1 Q9Y468 1/20 0.38
TYR P14679 3/20 0.38
MAPK1 P28482 1/20 0.37
MAPT P10636 2/20 0.37
KMT2A Q03164 2/20 0.37
LMNA P02545 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
TACR1 P25103 1/20 0.36
GAA P10253 1/20 0.35
CA3 P07451 1/20 0.34
MEN1 O00255 1/20 0.34
TP53 P04637 1/20 0.34
CYP3A4 P08684 1/20 0.34
ALOX5 P09917 1/20 0.34
ALOX15 P16050 1/20 0.34
HTT P42858 1/20 0.34
TDP1 Q9NUW8 1/20 0.34

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
SCHEMBL9968851 0.94 ALDH1A1 (0.41) ALDH1A1KDM4ETSHRL3MBTL1TYR
SCHEMBL9936951 0.92 TYR (0.44) ALDH1A1KDM4ETSHRL3MBTL1TYR
SCHEMBL9937438 0.91 ALDH1A1 (0.39) ALDH1A1KDM4ETSHRL3MBTL1TYR
SCHEMBL9937684 0.90 TYR (0.47) ALDH1A1KDM4ETSHRL3MBTL1TYR
SCHEMBL9937503 0.90 ALDH1A1 (0.39) ALDH1A1KDM4ETSHRL3MBTL1MAPK1
SCHEMBL9937665 0.90 TSHR (0.41) ALDH1A1KDM4ETSHRL3MBTL1MAPK1
SCHEMBL9938471 0.90 CYP19A1 (0.41) ALDH1A1TSHRL3MBTL1TYRMAPK1
SCHEMBL15341257 0.89 TYR (0.40) ALDH1A1TSHRL3MBTL1TYRMAPT
SCHEMBL9969475 0.87 ALDH1A1 (0.49) ALDH1A1TSHRL3MBTL1MAPK1MAPT
SCHEMBL9937177 0.86 L3MBTL1 (0.40) ALDH1A1TSHRL3MBTL1TYRMAPK1

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-8937187-B2 Method for depigmenting keratin materials using resorcinol derivatives L'OREAL (FR) 2015-01-20 US claimed
US-20130281507-A1 METHOD FOR DEPIGMENTING KERATIN MATERIALS USING RESORCINOL DERIVATIVES L'OREAL (FR) 2013-10-24 US claimed
EP-2651886-B1 METHOD FOR DEPIGMENTING KERATIN MATERIALS USING RESORCINOL DERIVATIVES ORÉAL L (FR) 2015-03-04 EP disclosed
US-8937187-B2 Method for depigmenting keratin materials using resorcinol derivatives L'OREAL (FR) 2015-01-20 US disclosed
US-8937187-B2 Method for depigmenting keratin materials using resorcinol derivatives L'OREAL (FR) 2015-01-20 US disclosed
US-8937187-B2 Method for depigmenting keratin materials using resorcinol derivatives L'OREAL (FR) 2015-01-20 US disclosed
US-20130281507-A1 METHOD FOR DEPIGMENTING KERATIN MATERIALS USING RESORCINOL DERIVATIVES L'OREAL (FR) 2013-10-24 US disclosed
US-20130281507-A1 METHOD FOR DEPIGMENTING KERATIN MATERIALS USING RESORCINOL DERIVATIVES L'OREAL (FR) 2013-10-24 US disclosed
US-20130281507-A1 METHOD FOR DEPIGMENTING KERATIN MATERIALS USING RESORCINOL DERIVATIVES L'OREAL (FR) 2013-10-24 US disclosed
WO-2012079938-A1 METHOD FOR DEPIGMENTING KERATIN MATERIALS USING RESORCINOL DERIVATIVES L'OREAL (FR) 2012-06-21 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-20130281507-A1 METHOD FOR DEPIGMENTING KERATIN MATERIALS USING RESORCINOL DERIVATIVES KRT18, KLHL20, IK ALDH1A1 222/4885KDM4E 300/4885TSHR 4359/4885

“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.