SCHEMBL20163295

SCHEMBL20163295

CCC(C(=O)Oc1ccccc1)=C(C)C

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ELANE P08246 3/20 0.45
MAPT P10636 3/20 0.41
ALDH1A1 P00352 3/20 0.41
CYP1A2 P05177 1/20 0.41
HSP90AA1 P07900 1/20 0.40
GAA P10253 1/20 0.40
RECQL P46063 1/20 0.39
ATM Q13315 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
RAB9A P51151 2/20 0.39
NPC1 O15118 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MTNR1A P48039 1/20 0.39
MTNR1B P49286 1/20 0.39
ALOX15 P16050 2/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 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
SCHEMBL29117671 0.85 ELANE (0.45) ELANEMAPTALDH1A1CYP1A2RECQL
SCHEMBL28856142 0.82 ELANE (0.50) ELANEMAPTALDH1A1L3MBTL1TDP1
SCHEMBL28144760 0.82 ELANE (0.42) ELANEMAPTALDH1A1CYP1A2GAA
SCHEMBL7688111 0.81 ELANE (0.47) ELANEMAPTALDH1A1HSP90AA1GAA
SCHEMBL237447 0.79 CES2 (0.50) ELANEMAPTALDH1A1RECQLATM
SCHEMBL20174131 0.78 ELANE (0.45) ELANEMAPTALDH1A1HSP90AA1GAA
SCHEMBL27546729 0.78 ELANE (0.45) ELANEMAPTALDH1A1HSP90AA1GAA
SCHEMBL14717313 0.78 ELANE (0.45) ELANEMAPTALDH1A1HSP90AA1GAA
SCHEMBL372385 0.78 ELANE (0.45) ELANEMAPTALDH1A1HSP90AA1GAA
Diphenyl Ethanedioat SCHEMBL27942895 0.78 ELANE (0.53) ELANEMAPTALDH1A1CYP1A2HSP90AA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10251826-B2 Alkaline agent for lightening hair containing oxidants and special carboxylic acid esters HENKEL AG & CO. KGAA (DE) 2019-04-09 US claimed
US-20180140523-A1 ALKALINE AGENT FOR LIGHTENING HAIR CONTAINING OXIDANTS AND SPECIAL CARBOXYLIC ACID ESTERS HENKEL AG & CO. KGAA (DE) 2018-05-24 US claimed
US-10251826-B2 Alkaline agent for lightening hair containing oxidants and special carboxylic acid esters HENKEL AG & CO. KGAA (DE) 2019-04-09 US disclosed
US-10251826-B2 Alkaline agent for lightening hair containing oxidants and special carboxylic acid esters HENKEL AG & CO. KGAA (DE) 2019-04-09 US disclosed
US-20180140523-A1 ALKALINE AGENT FOR LIGHTENING HAIR CONTAINING OXIDANTS AND SPECIAL CARBOXYLIC ACID ESTERS HENKEL AG & CO. KGAA (DE) 2018-05-24 US disclosed
US-20180140523-A1 ALKALINE AGENT FOR LIGHTENING HAIR CONTAINING OXIDANTS AND SPECIAL CARBOXYLIC ACID ESTERS HENKEL AG & CO. KGAA (DE) 2018-05-24 US disclosed
US-20180140523-A1 ALKALINE AGENT FOR LIGHTENING HAIR CONTAINING OXIDANTS AND SPECIAL CARBOXYLIC ACID ESTERS HENKEL AG & CO. KGAA (DE) 2018-05-24 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 (2 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-10251826-B2 Alkaline agent for lightening hair containing oxidants and special carboxylic acid esters KRT18, ALDH7A1, ALDH1A2 ELANE 1509/4885MAPT 1367/4885ALDH1A1 14/4885
US-20180140523-A1 ALKALINE AGENT FOR LIGHTENING HAIR CONTAINING OXIDANTS AND SPECIAL CARBOXYLIC ACID ESTERS KRT18, ALDH7A1, ALDH1A2 ELANE 1509/4885MAPT 1367/4885ALDH1A1 14/4885

“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.