SCHEMBL872902

SCHEMBL872902

C/C=C(/C)C(=O)OCCC(C)C

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA9 Q16790 1/20 0.41
TDP1 Q9NUW8 2/20 0.40
MAPK1 P28482 3/20 0.39
PKM P14618 2/20 0.39
HSD17B10 Q99714 1/20 0.39
ALOX15 P16050 1/20 0.38
LMNA P02545 1/20 0.37
ALDH1A1 P00352 3/20 0.37
KDM4E B2RXH2 1/20 0.37
GAA P10253 1/20 0.37
KMT2A Q03164 1/20 0.37
TSHR P16473 1/20 0.36
HTT P42858 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
ACHE P22303 1/20 0.35
PPARG P37231 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
SCHEMBL872903 1.00 CYP19A1 (0.41) CYP19A1CA12CA1CA2CA9
SCHEMBL3507005 1.00 CYP19A1 (0.41) CYP19A1CA12CA1CA2CA9
SCHEMBL3292504 0.86 ALOX15 (0.37) CYP19A1ALOX15ALDH1A1TSHRACHE
SCHEMBL3292506 0.86 ALOX15 (0.37) CYP19A1ALOX15ALDH1A1TSHRACHE
SCHEMBL28250022 0.86 ALOX15 (0.46) CYP19A1CA12CA1CA2CA9
SCHEMBL27824849 0.85 TSHR (0.41) TDP1ALDH1A1TSHRHTTPTPN1
SCHEMBL11580461 0.83 ALOX15 (0.34) ALOX15ALDH1A1
SCHEMBL27008262 0.83 CYP2D6 (0.36) ALOX15
SCHEMBL31359288 0.83 PTPN1 (0.37) CYP19A1CA12CA1CA2CA9
SCHEMBL873123 0.82 ALOX15 (0.42) ALOX15TSHRCHRNB2CHRNA4CHRNB4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4356894-A1 SUSTAINABLE PRODUCT WITH MALODORS Beiersdorf AG (DE) 2024-04-24 EP claimed
US-20190209441-A1 GEL NETWORK HAIR TREATMENT COMPOSITIONS WITH REDUCED ODOR WELLA OPERATIONS US, LLC 2019-07-11 US claimed
US-20190192408-A1 COMPOSITION FOR THE PERMANENT DEFORMATION OF HAIR HAVING REDUCED ODOUR WELLA OPERATIONS US, LLC 2019-06-27 US claimed
US-20190175476-A1 HAIR COLORING OR BLEACHING COMPOSITION WITH REDUCED ODOR WELLA OPERATIONS US, LLC 2019-06-13 US claimed
WO-2018053183-A1 COMPOSITION FOR THE PERMANENT DEFORMATION OF HAIR HAVING REDUCED ODOUR NOXELL CORPORATION (US) 2018-03-22 WO claimed
WO-2018053065-A1 COMPOSITION FOR THE PERMANENT DEFORMATION OF HAIR HAVING REDUCED ODOUR THE PROCTER & GAMBLE COMPANY (US) 2018-03-22 WO claimed
EP-3295925-A1 COMPOSITION FOR THE PERMANENT DEFORMATION OF HAIR HAVING REDUCED ODOUR Noxell Corporation (US) 2018-03-21 EP claimed
WO-2018048924-A1 GEL NETWORK HAIR TREATMENT COMPOSITIONS WITH REDUCED ODOR NOXELL CORPORATION (US) 2018-03-15 WO claimed
WO-2018048933-A1 HAIR COLORING OR BLEACHING COMPOSITION WITH REDUCED ODOR NOXELL CORPORATION (US) 2018-03-15 WO claimed
EP-3290086-A1 GEL NETWORK HAIR TREATMENT COMPOSITIONS WITH REDUCED ODOUR Noxell Corporation (US) 2018-03-07 EP claimed
CN-1273127-C Perfume composition SHISEIDO CO LTD (JP) 2006-09-06 CN claimed
WO-2006085048-A2 PRO-FRAGRANCE AND PRO-FLAVORANT COMPOSITIONS FLEXITRAL, INC. (US) 2006-08-17 WO claimed
US-6858575-B2 Pro-perfume compositions and substrate-treating products and methods using them PROCTER & GAMBLE COMPANY (US) 2005-02-22 US claimed
US-20040242452-A1 For effecting mental control through psycho-sedation or psycho-stimulation SHISEIDO COMPANY, LTD. (JP) 2004-12-02 US claimed
CN-1538840-A Perfume composition ������������ʽ���� 2004-10-20 CN claimed
EP-1448757-A1 PRO-PERFUME COMPOSITIONS USED IN CLEANING OR FABRIC TREATMENT PRODUCTS THE PROCTER & GAMBLE COMPANY (US) 2004-08-25 EP claimed
EP-1424071-A1 PERFUME COMPOSITIONS SHISEIDO COMPANY LIMITED (JP) 2004-06-02 EP claimed
US-20030171250-A1 Pro-perfume compositions and substrate-treating products and methods using them THE PROCTER & GAMBLE COMPANY 2003-09-11 US claimed
WO-2003046118-A1 PRO-PERFUME COMPOSITIONS USED IN CLEANING OR FABRIC TREATMENT PRODUCTS THE PROCTER & GAMBLE COMPANY (US) 2003-06-05 WO claimed
EP-1314777-A1 Pro-perfume compositions used in cleaning or fabric treatment products THE PROCTER & GAMBLE COMPANY (US) 2003-05-28 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 (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-20190192408-A1 COMPOSITION FOR THE PERMANENT DEFORMATION OF HAIR HAVING REDUCED ODOUR MAL2, MSH6, OR51E2 CYP19A1 2001/4885CA12 2307/4885CA1 3296/4885
US-20030171250-A1 Pro-perfume compositions and substrate-treating products and methods using them FASN, ALOX5, PAM CYP19A1 542/4885CA12 3116/4885CA1 2953/4885

“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.