SCHEMBL216731

SCHEMBL216731

CCc1[c]cccc1C

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL10626556 0.83 TSHR (0.36)
SCHEMBL258549 0.82 TSHR (0.32)
SCHEMBL365630 0.81 HEXA (0.36)
SCHEMBL28133189 0.79
SCHEMBL18705898 0.79
SCHEMBL18705643 0.79
SCHEMBL27954141 0.79
SCHEMBL819968 0.79 SKP2 (0.35)
SCHEMBL8974022 0.78 CNR1 (0.34)
SCHEMBL7668652 0.78 TAAR1 (0.39)

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 1345 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116410239-A Heteroatom-containing metallocene compound and preparation method and application thereof 惠生(中国)投资有限公司 2023-07-11 CN claimed
CN-115785083-A Cathepsin C small-molecule inhibitor and preparation method thereof 瑞石生物医药有限公司 2023-03-14 CN claimed
CN-110818545-B Method for preparing substituted aryl ketone by ketone arylation 上海化工研究院有限公司 2022-12-09 CN claimed
CN-110922286-B Asymmetric aryl substituted fulvene compound and preparation method and application thereof 上海化工研究院有限公司 2022-08-16 CN claimed
CN-112920199-A Piperazinone substituent or derivative thereof, and preparation method, application and pharmaceutical composition thereof 四川大学 2021-06-08 CN claimed
EP-2455426-B1 POLYCARBONATE RESIN COMPOSITION HAVING HIGH GLOSS AND IMPACT RESISTANCE AND GOOD SURFACE PROPERTIES, AND MOLDED ARTICLE USING THE SAME LOTTE ADVANCED MAT CO LTD (KR) 2021-01-06 EP claimed
CN-108164646-B Method for preparing polyisoprene by steam cracking of C5 naphtha fraction 中国石油化工股份有限公司 2020-09-15 CN claimed
CN-106349217-B Serine/threonine kinase inhibitors 阵列生物制药公司 2020-08-28 CN claimed
CN-108192002-B Method for preparing polyisoprene 中国石油化工股份有限公司 2020-07-24 CN claimed
CN-110922286-A Asymmetric aryl substituted fulvene compound and preparation method and application thereof 上海化工研究院有限公司 2020-03-27 CN claimed
WO-2001049689-A2 NOVEL SUBSTITUTED PYRAZOLO[4,3-e]DIAZEPINES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, USE AS MEDICINAL PRODUCTS AND PROCESSES FOR PREPARING THEM WARNER-LAMBERT COMPANY (US) 2001-07-12 WO claimed
US-6221989-B1 CRESOL-FORMALDEHYDE RESIN CONTAINING TRIAZINE GROUPS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2001-04-24 US claimed
US-5952529-A CATALYTIC AMINATION OF ALKANE OR ARYLALKANE DERIVATIVES COMPRISES CONTACTING ALKANE OR ARYLALKANE DERIVATIVES WITH AMMONIA OR REACTANT AMINE IN PRESENCE OF HYDROGEN AND NICKEL-RHENIUM-COBALT-BORON-COPPER OR RUTHENIUM CATALYST THE DOW CHEMICAL COMPANY (US) 1999-09-14 US claimed
US-5789490-A Amine capped polyethers and process for producing same THE DOW CHEMICAL COMPANY (US) 1998-08-04 US claimed
EP-0853641-A1 AMINE CAPPED POLYETHERS AND PROCESS FOR PRODUCING SAME THE DOW CHEMICAL COMPANY (US) 1998-07-22 EP claimed
EP-0828558-A1 CATALYST AND PROCESS FOR PRODUCING AMINES THE DOW CHEMICAL COMPANY (US) 1998-03-18 EP claimed
WO-1997012928-A1 AMINE CAPPED POLYETHERS AND PROCESS FOR PRODUCING SAME THE DOW CHEMICAL COMPANY (US) 1997-04-10 WO claimed
WO-1996038226-A1 CATALYST AND PROCESS FOR PRODUCING AMINES THE DOW CHEMICAL COMPANY (US) 1996-12-05 WO claimed
US-4797347-A Process for producing electrically conductive coating CIBA-GEIGY CORPORATION (US) 1989-01-10 US claimed
US-4626556-A LADDER POLYMERS JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1986-12-02 US claimed