SCHEMBL159454

SCHEMBL159454

CC(C)c1[c]cccc1C(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 3/20 0.41
GABRB2 P47870 2/20 0.41
GABRG2 P18507 2/20 0.41
GABRB3 P28472 2/20 0.41
FAAH O00519 2/20 0.41
CYP3A4 P08684 2/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
LMNA P02545 1/20 0.41
CYP1A2 P05177 1/20 0.41
HPGD P15428 1/20 0.41
TSHR P16473 1/20 0.41
GABRB1 P18505 1/20 0.41
PTGS1 P23219 1/20 0.41
SLC6A2 P23975 1/20 0.41
HTR2C P28335 1/20 0.41
GABRA5 P31644 1/20 0.41
GABRA3 P34903 1/20 0.41
HTR2B P41595 1/20 0.41
GABRA2 P47869 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
SCHEMBL28217242 0.78
SCHEMBL3821405 0.76
SCHEMBL6013934 0.76 GABRA1 (0.41) GABRA1GABRB2GABRG2GABRB3FAAH
SCHEMBL2958797 0.76 TSHR (0.35) CYP1A2TSHRALDH1A1
SCHEMBL3608275 0.74 GABRA1 (0.39) GABRA1GABRB2GABRG2GABRB3FAAH
SCHEMBL6007538 0.74 GABRA1 (0.39) GABRA1GABRB2GABRG2GABRB3FAAH
SCHEMBL6487833 0.74 GABRA1 (0.39) GABRA1GABRB2GABRG2GABRB3FAAH
SCHEMBL555031 0.74 GABRA1 (0.43) GABRA1GABRB2GABRG2GABRB3FAAH
SCHEMBL11075023 0.74 GABRA1 (0.43) GABRA1GABRB2GABRG2GABRB3FAAH
SCHEMBL19405603 0.74 ALDH1A1 (0.32) ALDH1A1

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 1550 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12024613-B2 Composition containing a polymer and an additive École Polytechnique Fédérale De Lausanne (EPFL)—Technology Transfer Office (TTO) (CH) 2024-07-02 US claimed
CN-118184915-A Propylene and alpha-olefin multi-block copolymer elastomer material, and preparation method and application thereof 天津大学 2024-06-14 CN claimed
CN-117831652-A Prediction method of olefin hydroformylation positive-to-negative ratio 上海华谊控股集团有限公司 2024-04-05 CN claimed
CN-117820529-A Rare earth metal catalyst composition and preparation method and application thereof 中国石油天然气股份有限公司 2024-04-05 CN claimed
WO-2024066457-A1 RARE EARTH METAL CATALYST COMPOSITION, PREPARATION METHOD THEREFOR, AND USE THEREOF 中国石油天然气股份有限公司 2024-04-04 WO claimed
CN-114206886-B Gold (III) compound, method for preparing the same, and organic light emitting device using the same 广东聚华印刷显示技术有限公司 2024-02-27 CN claimed
CN-117551134-A Complex and preparation method and application thereof 南京佳诺霖光电科技有限公司 2024-02-13 CN claimed
CN-115557505-B Pre-lithiated silicon-based negative electrode material and preparation method thereof 合肥国轩高科动力能源有限公司 2024-02-06 CN claimed
WO-2024022413-A1 DIVALENT METAL COMPLEX, PREPARATION METHOD THEREFOR AND USE THEREOF, AND ORGANIC OPTOELECTRONIC DEVICE 中国石油化工股份有限公司 2024-02-01 WO claimed
CN-117466944-A Divalent metal complex, preparation method and application thereof, and organic photoelectric device 中国石油化工股份有限公司 2024-01-30 CN claimed
EP-0498088-B1 Method of preparing a mixture of polyphenylene ether and polyvinylaromatic compound GEN ELECTRIC (US) 1995-07-05 EP claimed
EP-0330419-B1 Process for the preparation of indigo compound MITSUI TOATSU CHEMICALS (JP) 1994-10-26 EP claimed
US-5159074-A AMINOMETHANEPHOSPHONIC ACID ARYL ESTERS, A PROCESS FOR THEIR PRODUCTION AND THEIR USE BAYER AKTIENGESELLSCHAFT (DE) 1992-10-27 US claimed
EP-0509034-A1 HOMOGENEOUS RHENIUM CATALYSTS FOR METATHESIS OF OLEFINS MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 1992-10-21 EP claimed
US-5146033-A Homogeneous rhenium catalysts for metathesis of olefins MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 1992-09-08 US claimed
US-5087710-A HOMOGENEOUS RHENIUM CATALYSTS FOR METATHESIS OF OLEFINS MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 1992-02-11 US claimed
EP-0465379-A1 Piperidine derivatives and their use in polymers RHONE-POULENC CHIMIE (FR) 1992-01-08 EP claimed
WO-1991009825-A1 HOMOGENEOUS RHENIUM CATALYSTS FOR METATHESIS OF OLEFINS MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 1991-07-11 WO claimed
US-4370281-A FIREPROOFING CIBA-GEIGY AG (CH) 1983-01-25 US claimed
EP-0025720-A1 Process for the manufacture of mixed phosphoric acid ester compositions and plasticised polymers containing them FMC Corporation (US) 1981-03-25 EP claimed