SCHEMBL112576

SCHEMBL112576

CC(=O)OCC1=CC[C@@H]2C[C@H]1C2(C)C

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 7/20 0.49
KDM4E B2RXH2 2/20 0.49
TSHR P16473 2/20 0.49
HTT P42858 1/20 0.49
MAPK1 P28482 2/20 0.47
SCN9A Q15858 1/20 0.45
KCNH2 Q12809 1/20 0.45
CXCR3 P49682 5/20 0.44
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL112577 1.00 TDP1 (0.49) TDP1KDM4ETSHRHTTMAPK1
SCHEMBL15798094 1.00 TDP1 (0.49) TDP1KDM4ETSHRHTTMAPK1
SCHEMBL12032197 1.00 TDP1 (0.49) TDP1KDM4ETSHRHTTMAPK1
SCHEMBL15798092 1.00 TDP1 (0.49) TDP1KDM4ETSHRHTTMAPK1
Acetic Acid SCHEMBL14764134 0.97 KDM4E (0.47) TDP1KDM4ETSHRHTTMAPK1
Myrtenol SCHEMBL5606226 0.94 TDP1 (0.45) TDP1KDM4ETSHRHTTMAPK1
SCHEMBL9984718 0.89 TDP1 (0.50) TDP1KDM4ETSHRHTTMAPK1
SCHEMBL9984711 0.89 TDP1 (0.50) TDP1KDM4ETSHRHTTMAPK1
SCHEMBL9984712 0.88 KDM4E (0.49) TDP1KDM4ETSHRHTTMAPK1
SCHEMBL18492322 0.86 TDP1 (0.45) TDP1KDM4ETSHRHTTMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122042875-A Method for directionally extracting sweet smell characteristic mark components from Shennong chrysanthemum 北京林业大学 2026-05-15 CN claimed
US-12514798-B2 Use of [6]-paradol for stabilization of cosmetic compositions SYMRISE AG (DE) 2026-01-06 US claimed
CN-118169281-A Method for detecting content of myrtenyl acetate in valerian essential oil 多特瑞(上海)生物科技有限公司 2024-06-11 CN claimed
WO-2023068082-A1 AROMATIC PARTICLE DISPERSION AND AQUEOUS INK COMPOSITION FOR WRITING INSTRUMENT CONTAINING SAME 三菱鉛筆株式会社 2023-04-27 WO claimed
WO-2018145219-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTING AND TREATING ADDICTIONS BY MEANS OF AVERSIVE COUNTERCONDITIONING SERANI MOSTAZAL JORGE (CL) 2018-08-16 WO claimed
EP-2849718-B1 MIXTURES HAVING IMPROVED COOLING EFFECT SYMRISE AG (DE) 2017-02-01 EP claimed
US-20150139918-A1 MIXTURES HAVING IMPROVED COOLING EFFECT SYMRISE AG (DE) 2015-05-21 US claimed
WO-2014091185-A1 USE OF A COMPOUND TO CONTROL INSECTS SWANSEA UNIVERSITY (GB) 2014-06-19 WO claimed
WO-2014085626-A1 LIGHT MODULATION OF PLANTS AND PLANT PARTS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2014-06-05 WO claimed
US-8569383-B2 Utilization of rhinologically active substances SYMRISE AG (DE) 2013-10-29 US claimed
WO-2005066187-A1 ACTIVE INGREDIENT-RELEASING CYCLIC SILOXANES GENERAL ELECTRIC COMPANY (US) 2005-07-21 WO claimed
US-20050136021-A1 Active-releasing cyclic siloxanes MOMENTIVE PERFORMANCE MATERIALS INC. 2005-06-23 US claimed
US-20050136022-A1 Cyclic siloxane compositions for the release of active ingredients MOMENTIVE PERFORMANCE MATERIALS INC. 2005-06-23 US claimed
US-20030036489-A1 Consumable composition comprising perfumed particles and article containing the same THE PROCTER & GAMBLE COMPANY 2003-02-20 US claimed
WO-2002090479-A1 PERFUMED PARTICLES AND ARTICLES CONTAINING THE SAME THE PROCTER & GAMBLE COMPANY (US) 2002-11-14 WO claimed
WO-2002090481-A1 COMPOSITIONS AND ARTICLES FOR EFFECTIVE DEPOSITION OF PERFUME THE PROCTER & GAMBLE COMPANY (US) 2002-11-14 WO claimed
US-6322838-B1 Mint and/or fruit flavor compositions HAARMANN & REIMER GMBH (DE) 2001-11-27 US claimed
EP-0018679-B1 SURFACTANT CAKE COMPOSITIONS CONTAINING SOLUBILITY REDUCING AGENTS THE PROCTER & GAMBLE COMPANY (US) 1983-03-16 EP claimed
US-4246129-A TOILET TANK DISPENSERS THE PROCTER & GAMBLE COMPANY (US) 1981-01-20 US claimed
EP-0018679-A1 Surfactant cake compositions containing solubility reducing agents THE PROCTER & GAMBLE COMPANY (US) 1980-11-12 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 (3 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-20150139918-A1 MIXTURES HAVING IMPROVED COOLING EFFECT BCL2A1, HSPE1, BCL2 TDP1 846/4885KDM4E 2678/4885TSHR 2762/4885
US-20050136022-A1 Cyclic siloxane compositions for the release of active ingredients F9, RPL39, ECPAS TDP1 3632/4885KDM4E 94/4885TSHR 4528/4885
US-20050136021-A1 Active-releasing cyclic siloxanes F9, RPL39, ALDH16A1 TDP1 3581/4885KDM4E 79/4885TSHR 4168/4885

“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.