SCHEMBL123485

SCHEMBL123485

C=C(C)C.C=Cc1ccc(C)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.55
CYP3A4 P08684 1/20 0.53
CYP2C9 P11712 1/20 0.53
CYP2C19 P33261 1/20 0.53
CYP2A6 P11509 1/20 0.44
TDP1 Q9NUW8 4/20 0.43
TP53 P04637 2/20 0.43
RAB9A P51151 2/20 0.42
NPC1 O15118 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
TSHR P16473 1/20 0.42
MAPT P10636 3/20 0.41
KDM4E B2RXH2 1/20 0.41
POLB P06746 1/20 0.41
RECQL P46063 1/20 0.41
MDM2 Q00987 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CA1 P00915 1/20 0.41
HDAC8 Q9BY41 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
SCHEMBL2849520 0.93 CYP3A4 (0.48) ALDH1A1CYP3A4CYP2C9CYP2C19CYP2A6
SCHEMBL11325348 0.91 ALDH1A1 (0.50) ALDH1A1CYP3A4CYP2C9CYP2C19CYP2A6
SCHEMBL7672210 0.91 ALDH1A1 (0.50) ALDH1A1CYP3A4CYP2C9CYP2C19CYP2A6
SCHEMBL679555 0.89 ALDH1A1 (0.69) ALDH1A1CYP3A4CYP2C9CYP2C19CYP2A6
SCHEMBL14911 0.89
Hexane SCHEMBL28578368 0.88 CYP3A4 (0.44) ALDH1A1CYP3A4CYP2C9CYP2C19CYP2A6
Ethane SCHEMBL23051531 0.87 ALDH1A1 (0.65) ALDH1A1CYP3A4CYP2C9CYP2C19CYP2A6
Hydrochloric Acid SCHEMBL9861453 0.87 ALDH1A1 (0.65) ALDH1A1CYP3A4CYP2C9CYP2C19CYP2A6
Ammonia Solution, Strong SCHEMBL9397572 0.87 ALDH1A1 (0.65) ALDH1A1CYP3A4CYP2C9CYP2C19CYP2A6
Hydrochloric Acid SCHEMBL9861440 0.87 ALDH1A1 (0.65) ALDH1A1CYP3A4CYP2C9CYP2C19CYP2A6

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 1080 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4379849-A2 ALL-SOLID SECONDARY BATTERY Samsung SDI Co., Ltd (KR) 2024-06-05 EP claimed
US-20240178443-A1 ALL-SOLID SECONDARY BATTERY SAMSUNG SDI CO., LTD. (KR) 2024-05-30 US claimed
CN-113227290-B Silane compound and composition thereof 引能仕株式会社 2024-05-03 CN claimed
WO-2024071407-A1 SILANE COMPOUND AND COMPOSITION CONTAINING SAME ENEOS株式会社 2024-04-04 WO claimed
CN-113004706-B Biorenewable hydrocarbon compositions and uses thereof 克拉通聚合物研究有限公司 2024-03-29 CN claimed
CN-116917405-A Thermoplastic vulcanizate compositions comprising cycloolefin copolymers 国际人造丝公司 2023-10-20 CN claimed
US-20230307793-A1 ALL SOLID SECONDARY BATTERY AND METHOD OF MANUFACTURING THE SAME SAMSUNG SDI CO., LTD. (KR) 2023-09-28 US claimed
EP-4250423-A1 ALL SOLID SECONDARY BATTERY AND METHOD OF MANUFACTURING THE SAME Samsung SDI Co., Ltd. (KR) 2023-09-27 EP claimed
EP-3701172-B1 FLEXIBLE TUBE HAVING A DETECTABLE LAYER CONTITECH SCHLAUCH GMBH (DE) 2023-08-30 EP claimed
CN-116234686-A Inner layer of vehicle air conditioner hose 康蒂泰克化学技术有限公司 2023-06-06 CN claimed
EP-0586383-A4 BREAKER CHEMICAL ENCAPSULATED WITH A CROSSLINKED ELASTOMER COATING EXXON RESEARCH ENGINEERING CO (US) 1994-05-18 EP claimed
EP-0639241-A4 ENCAPSULATED BREAKER CHEMICAL. EXXON RESEARCH ENGINEERING CO (US) 1994-03-31 EP claimed
EP-0586383-A1 BREAKER CHEMICAL ENCAPSULATED WITH A CROSSLINKED ELASTOMER COATING EXXON RESEARCH AND ENGINEERING COMPANY (US) 1994-03-16 EP claimed
EP-0585228-A1 ENCAPSULATED BREAKER CHEMICAL WITH A MULTI-COAT LAYER UREA EXXON RESEARCH AND ENGINEERING COMPANY (US) 1994-03-09 EP claimed
WO-1992017683-A1 BREAKER CHEMICAL ENCAPSULATED WITH A CROSSLINKED ELASTOMER COATING EXXON RESEARCH AND ENGINEERING COMPANY (US) 1992-10-15 WO claimed
WO-1992012328-A1 ENCAPSULATED BREAKER CHEMICAL WITH A MULTI-COAT LAYER UREA EXXON RESEARCH AND ENGINEERING COMPANY (US) 1992-07-23 WO claimed
WO-1992012327-A1 ENCAPSULATED BREAKER CHEMICAL EXXON RESEARCH AND ENGINEERING COMPANY (US) 1992-07-23 WO claimed
US-5110486-A Neutralized sulfonated elastomeric copolymer; sustained release EXXON RESEARCH AND ENGINEERING COMPANY (US) 1992-05-05 US claimed
US-5102559-A Particulate breaker composition sealed with a water soluble layer and coated with a neutralized sulfonated elastomeric polymer for fracturing subterranean formations EXXON RESEARCH AND ENGINEERING COMPANY (US) 1992-04-07 US claimed
US-5102558-A Neutralized sulfonated elastomers EXXON RESEARCH AND ENGINEERING COMPANY (US) 1992-04-07 US claimed