SCHEMBL873285

SCHEMBL873285

CC(C)C(=O)OC(C)(C)Cc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.55
CYP2C9 P11712 2/20 0.55
CYP2C19 P33261 2/20 0.55
CYP1A2 P05177 1/20 0.55
CYP2D6 P10635 1/20 0.55
NFKB1 P19838 1/20 0.55
LMNA P02545 1/20 0.54
PMP22 Q01453 1/20 0.54
NLRP3 Q96P20 1/20 0.54
CTSK P43235 2/20 0.48
TRPA1 O75762 1/20 0.46
MMP8 P22894 1/20 0.44
ALDH1A1 P00352 3/20 0.44
TSHR P16473 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HIF1A Q16665 1/20 0.42
SLC6A2 P23975 1/20 0.41
TAAR1 Q96RJ0 1/20 0.41
RECQL P46063 1/20 0.41
PPARG P37231 1/20 0.41

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
SCHEMBL19177231 0.87 CYP3A4 (0.43) CYP3A4CYP2C9CYP2C19CYP1A2CYP2D6
SCHEMBL11259061 0.87 CYP3A4 (0.52) CYP3A4CYP2C9CYP2C19CYP1A2CYP2D6
SCHEMBL11259618 0.87 CYP3A4 (0.73) CYP3A4CYP2C9CYP2C19CYP1A2CYP2D6
Hydrochloric Acid SCHEMBL11258201 0.85 LMNA (0.74) CYP3A4CYP2C9CYP2C19CYP1A2CYP2D6
SCHEMBL14355533 0.85 CYP3A4 (0.57) CYP3A4CYP2C9CYP2C19CYP1A2CYP2D6
SCHEMBL3504292 0.83 NAAA (0.44) CYP3A4CYP2C9CYP2C19CYP1A2CYP2D6
SCHEMBL19220803 0.83 CYP3A4 (0.56) CYP3A4CYP2C9CYP2C19CYP1A2CYP2D6
SCHEMBL19220802 0.83 CYP3A4 (0.56) CYP3A4CYP2C9CYP2C19CYP1A2CYP2D6
SCHEMBL12390094 0.82 KCNH2 (0.44) CYP3A4CYP2C9CYP2C19CYP1A2CYP2D6
SCHEMBL1003604 0.82 CTSK (0.49) CYP3A4CYP2C9CYP2C19CYP1A2CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4519404-A1 METHODS FOR ENHANCING MENTAL PERFORMANCE AND COMPOSITIONS FOR USE THEREIN Firmenich SA (CH) 2025-03-12 EP disclosed
EP-4514477-A1 FRAGRANCE COMPOSITIONS HAVING LONG-LASTING TRAIL PERFORMANCE Firmenich SA (CH) 2025-03-05 EP disclosed
WO-2023247604-A1 METHODS FOR ENHANCING MENTAL PERFORMANCE AND COMPOSITIONS FOR USE THEREIN FIRMENICH SA (CH) 2023-12-28 WO disclosed
US-11674110-B2 Compositions containing lauryl methacrylate for malodor reduction and uses thereof AGILEX FLAVORS AND FRAGRANCES, INC (US) 2023-06-13 US disclosed
EP-3360175-B1 FORMULATIONS COMPRISING AT LEAST TWO ORGANIC SEMICONDUCTING COMPOUNDS AND AT LEAST TWO SOLVENTS MERCK PATENT GMBH (DE) 2023-05-17 EP disclosed
US-20220370328-A1 Clear Nail Top Coat Compositions And Methods Of Making ILNP Cosmetics Inc. (US) 2022-11-24 US disclosed
CN-110891615-B System and method for selecting and releasing fragrance 阿甘香气及精细化学有限公司 2022-08-05 CN disclosed
US-20220241177-A1 Clear Nail Top Coat Compositions And Methods Of Making ILNP Cosmetics Inc. 2022-08-04 US disclosed
EP-3325707-B1 COMPOSITIONS FOR MALODOR REDUCTION AND USE THEREOF AGILEX FLAVORS & FRAGRANCES INC (US) 2021-09-29 EP disclosed
WO-2021076238-A1 CLEAR NAIL TOP COAT COMPOSITIONS AND METHODS OF MAKING ILNP Cosmetics Inc. (US) 2021-04-22 WO disclosed
US-20090087401-A1 DEODORANT COMPOSITION TAKASAGO INTERNATIONAL CORPORATION (JP) 2009-04-02 US disclosed
CN-100374379-C Water treatment composition containing masking agent and method for purifying drinking water PUR WATER PURIFICATION PROD (US) 2008-03-12 CN disclosed
US-20060165622-A1 Deodorant composition TAKASAGO INTERNATIONAL CORPORATION (JP) 2006-07-27 US disclosed
CN-1750997-A Water treatment composition containing masking agent PUR WATER PURIFICATION PROD (US) 2006-03-22 CN disclosed
EP-1561476-A1 DEODORANT COMPOSITION Takasago International Corporation (JP) 2005-08-10 EP disclosed
EP-1067118-B1 Cyclopentylalkyl-nitriles and the use of odoriferous cyclopentylalkyl derivatives as fragrances GIVAUDAN SA (CH) 2004-03-31 EP disclosed
US-6441052-B1 ALKANOL, ALDEHYDE, AND KETONE CYCLOPENTA DERIVATIVES; FRAGRANCES GIVAUDAN SA (CH) 2002-08-27 US disclosed
US-6410000-B1 PERFUME GIVAUDAN SA (CH) 2002-06-25 US disclosed
US-6399811-B1 ORGANOLEPTIC GIVAUDAN SA (CH) 2002-06-04 US disclosed
EP-1067118-A1 Cyclopentylalkyl-nitriles and the use of odoriferous cyclopentylalkyl derivatives as fragrances Givaudan SA (CH) 2001-01-10 EP 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-20220370328-A1 Clear Nail Top Coat Compositions And Methods Of Making POLR1C, KAT2A, COL2A1 CYP3A4 676/4885CYP2C9 741/4885CYP2C19 1055/4885

“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.