SCHEMBL309186

SCHEMBL309186

C=C[C@@]1(C)CC[C@@H](O)C(C)(C)O1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 5/20 0.34
CYP3A4 P08684 4/20 0.34
TSHR P16473 3/20 0.34
ADCY1 Q08828 3/20 0.34
GMNN O75496 1/20 0.34
BLM P54132 1/20 0.34
PMP22 Q01453 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
CYP2D6 P10635 1/20 0.34
NFKB1 P19838 1/20 0.34
HIF1A Q16665 1/20 0.34
NR1I2 O75469 1/20 0.34
CHRM2 P08172 1/20 0.34
ABCB1 P08183 1/20 0.34
HTR1A P08908 1/20 0.34
ADRA2A P08913 1/20 0.34
SLC2A1 P11166 1/20 0.34
HTR2A P28223 1/20 0.34
ADRA1A P35348 1/20 0.34
SCN1A P35498 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
SCHEMBL4962408 1.00 MAPK1 (0.34) MAPK1CYP3A4TSHRADCY1GMNN
SCHEMBL309187 1.00 MAPK1 (0.34) MAPK1CYP3A4TSHRADCY1GMNN
SCHEMBL30894550 1.00 MAPK1 (0.34) MAPK1CYP3A4TSHRADCY1GMNN
SCHEMBL15628048 0.77 CYP3A4 (0.32) CYP3A4
SCHEMBL30005620 0.73 MAPK1 (0.32) MAPK1CYP3A4TSHRADCY1GMNN
SCHEMBL29983168 0.73 MAPK1 (0.32) MAPK1CYP3A4TSHRADCY1GMNN
SCHEMBL21443881 0.73 MAPK1 (0.32) MAPK1CYP3A4TSHRADCY1GMNN
SCHEMBL30004895 0.73 MAPK1 (0.32) MAPK1CYP3A4TSHRADCY1GMNN
SCHEMBL9550153 0.71
SCHEMBL11034667 0.71 MAPK1 (0.39) MAPK1CYP3A4TSHRADCY1GMNN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230301329-A1 COMPOSITIONS COMPRISING COOLNESS-REGULATING AGENT, AND METHOD OF USE THEREOF EPC NATURAL PRODUCTS CO., LTD. (CN) 2023-09-28 US claimed
US-11751593-B2 Sweetener and flavor compositions, methods of making and methods of use thereof EPC Natural Products Co., Ltd (CN) 2023-09-12 US claimed
US-20210386104-A1 WATER SOLUBLE FLAVOR COMPOSITIONS, METHODS OF MAKING AND METHODS OF USE THEREOF EPC Natural Products Co., Ltd (CN) 2021-12-16 US claimed
CN-113271793-A Water-soluble flavor composition, preparation method and application method thereof 伊比西(北京)植物药物技术有限公司 2021-08-17 CN claimed
US-20200138071-A1 SWEETENER AND FLAVOR COMPOSITIONS, METHODS OF MAKING AND METHODS OF USE THEREOF EPC Natural Products Co., Ltd (CN) 2020-05-07 US claimed
US-20230301329-A1 COMPOSITIONS COMPRISING COOLNESS-REGULATING AGENT, AND METHOD OF USE THEREOF EPC NATURAL PRODUCTS CO., LTD. (CN) 2023-09-28 US disclosed
US-11751593-B2 Sweetener and flavor compositions, methods of making and methods of use thereof EPC Natural Products Co., Ltd (CN) 2023-09-12 US disclosed
US-20210386104-A1 WATER SOLUBLE FLAVOR COMPOSITIONS, METHODS OF MAKING AND METHODS OF USE THEREOF EPC Natural Products Co., Ltd (CN) 2021-12-16 US disclosed
EP-2145042-B2 TEXTILE SCENTING HENKEL AG & CO KGAA (DE) 2021-10-06 EP disclosed
CN-113271793-A Water-soluble flavor composition, preparation method and application method thereof 伊比西(北京)植物药物技术有限公司 2021-08-17 CN disclosed
US-20200138071-A1 SWEETENER AND FLAVOR COMPOSITIONS, METHODS OF MAKING AND METHODS OF USE THEREOF EPC Natural Products Co., Ltd (CN) 2020-05-07 US disclosed
EP-2145042-B1 TEXTILE SCENTING HENKEL AG & CO KGAA (DE) 2018-01-17 EP disclosed
WO-2008003631-A1 WASHING, CLEANING AND CARE PRODUCTS HENKEL AG & CO. KGAA (DE) 2008-01-10 WO disclosed
WO-2007131529-A1 TEXTILE TREATMENT AGENT HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-11-22 WO disclosed
WO-2007118733-A1 WASHING OR CLEANSING AGENT GRANULATES HENKEL AG & CO. KGAA (DE) 2007-10-25 WO disclosed
WO-2007090451-A1 FLUID RESERVOIR HENKEL AG & CO. KGAA (DE) 2007-08-16 WO disclosed
WO-2007028478-A1 PARTICLES CONTAINING PERFUME HAVING IMPROVED FRAGRANCED PROPERTIES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-03-15 WO disclosed
WO-2007028477-A1 CONSUMER PRODUCTS HAVING VARYING ODOR PATTERNS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-03-15 WO disclosed
WO-2007028480-A1 PARTICLES CONTAINING ZEOLITE AND PERFUME HAVING IMPROVED FRAGRANCE PROPERTIES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-03-15 WO disclosed
WO-2007028479-A1 CONSUMER PRODUCTS HAVING VARYING ODORS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-03-15 WO disclosed