SCHEMBL516188

SCHEMBL516188

Cc1cc(O)cc(C)c1C=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 6/20 0.46
ALOX15 P16050 2/20 0.46
CHRM1 P11229 1/20 0.46
MAOA P21397 1/20 0.46
TBXA2R P21731 1/20 0.46
ADRA1A P35348 1/20 0.46
HTR2B P41595 1/20 0.46
MAPT P10636 2/20 0.44
ACHE P22303 2/20 0.41
ERN1 O75460 4/20 0.41
RAF1 P04049 2/20 0.40
ALDH1A1 P00352 2/20 0.39
PKMYT1 Q99640 1/20 0.39
CYTH2 Q99418 2/20 0.38
NUAK1 O60285 1/20 0.38
IGF1R P08069 1/20 0.38
PIM1 P11309 1/20 0.38
SRC P12931 1/20 0.38
KDR P35968 1/20 0.38
PLK1 P53350 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
SCHEMBL869070 0.88 CYP3A4 (0.48) CYP3A4ALOX15CHRM1MAOATBXA2R
SCHEMBL18646094 0.84 ERN1 (0.40) CYP3A4ALOX15CHRM1MAOATBXA2R
SCHEMBL28721593 0.83 CYP3A4 (0.39) CYP3A4ALOX15CHRM1MAOATBXA2R
SCHEMBL2027384 0.81 ERN1 (0.58) CYP3A4MAPTERN1ALDH1A1MEN1
SCHEMBL25342989 0.79 CYP3A4 (0.48) CYP3A4ALOX15MAPTERN1ALDH1A1
SCHEMBL7253421 0.78 TTR (0.42) CYP3A4MAPTACHEERN1CYTH2
SCHEMBL79252 0.78 ERN1 (0.44) CYP3A4MAPTERN1ALDH1A1MEN1
SCHEMBL1929437 0.78 ERN1 (0.44) CYP3A4MAPTERN1ALDH1A1MEN1
SCHEMBL7795203 0.77 KAT6A (0.42) MAOAMAPTERN1ALDH1A1MEN1
SCHEMBL30230044 0.77 ESR2 (0.58) MAOAMAPTALDH1A1CYTH2MEN1

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 768 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250075147-A1 FRAGRANCE AND FLAVOR COMPOSITIONS COMPRISING NEW FLAVOR AND FRAGRANCE INGREDIENTS OSMO LABS, PBC 2025-03-06 US claimed
CN-116199639-B Tris (3, 5-dimethyl-4-nitriloxyphenoxy) triazine compound and synthesis method thereof 西安近代化学研究所 2025-01-14 CN claimed
CN-119219704-A Long-life room temperature phosphorescent material based on polyphosphazene and application thereof 重庆理工大学 2024-12-31 CN claimed
CN-116462612-B Tetrafunctional aromatic nitrile oxide compound and synthesis method thereof 西安近代化学研究所 2024-07-02 CN claimed
CN-115819288-B Nitrile oxide, difunctional nitrile oxide and preparation method thereof 西安近代化学研究所 2024-05-28 CN claimed
CN-116003299-B Difunctional nitrile oxide, preparation method and application thereof 西安近代化学研究所 2024-05-28 CN claimed
CN-115784933-B Difunctional nitrile oxide, preparation method and application thereof 西安近代化学研究所 2024-04-30 CN claimed
CN-115536555-B 1, 2-Bis (2- (3, 5-dimethyl-4-nitriloxyphenoxy) ethoxy) ethane compound 西安近代化学研究所 2024-04-30 CN claimed
CN-115784941-B Trifunctional nitrile oxide, preparation method and application thereof 西安近代化学研究所 2024-03-22 CN claimed
US-11918671-B2 Multi-tone hair dyeing method in three steps HENKEL AG & CO. KGAA (DE) 2024-03-05 US claimed
WO-2005051336-A1 METHOD FOR DYEING FIBRES CONTAINING KERATINE HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2005-06-09 WO claimed
EP-1534227-A1 AGENTS USED FOR DYEING KERATINOUS FIBERS Henkel Kommanditgesellschaft auf Aktien (DE) 2005-06-01 EP claimed
WO-2004058200-A1 AGENT FOR DYING KERATIN FIBERS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2004-07-15 WO claimed
WO-2004058202-A1 DYE TABLETS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2004-07-15 WO claimed
EP-1433469-A1 Composition for dyeing keratinous fibres Henkel Kommanditgesellschaft auf Aktien (DE) 2004-06-30 EP claimed
WO-2004022016-A1 AGENTS USED FOR DYEING KERATINOUS FIBERS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2004-03-18 WO claimed
US-6635090-B1 Dyeing method using a specific cationic derivative and a compound selected among a specific aldehyde, a specific ketone, a quinone and a di-imino-isoindoline or 3-amino-isoindolone derivative L'OREAL, S.A. (FR) 2003-10-21 US claimed
US-6458168-B1 Hair dyeing method using an aliphatic cationic amine and compound chosen from an aldehyde, a ketone, a quinone, a di-imino-isoindoline, and a 3-aminoisoindolone derivative L'OREAL S.A. (FR) 2002-10-01 US claimed
US-6451067-B1 HAIR DYE MIXTURE L'OREAL S.A. (FR) 2002-09-17 US claimed
EP-0378265-B1 Low-temperature curable compositions based upon polyaromatic aldehyde group-containing compounds and ketiminized polyamino compounds AKZO NOBEL NV (NL) 1994-06-08 EP claimed

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-11918671-B2 Multi-tone hair dyeing method in three steps TYR, HAO2, HAAO CYP3A4 2007/4885ALOX15 770/4885CHRM1 2436/4885

“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.