SCHEMBL5000035

SCHEMBL5000035

CCCCC(CC)CC=Cc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 3/20 0.50
LMNA P02545 3/20 0.45
TSHR P16473 1/20 0.45
ALDH1A1 P00352 4/20 0.43
KDM4E B2RXH2 1/20 0.43
CA2 P00918 1/20 0.41
CYP3A4 P08684 1/20 0.41
TDP1 Q9NUW8 2/20 0.39
CTSC P53634 1/20 0.39
GRIK1 P39086 2/20 0.38
GRIK2 Q13002 2/20 0.38

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
SCHEMBL28420093 0.94 HTR2A (0.47) HTR2ALMNATSHRALDH1A1KDM4E
SCHEMBL6286622 0.86 HTR2A (0.60) HTR2ACTSCGRIK1GRIK2
SCHEMBL329206 0.83 ALDH1A1 (0.45) LMNATSHRALDH1A1KDM4ECA2
SCHEMBL31038595 0.81 TDP1 (0.60) LMNATSHRALDH1A1KDM4ECYP3A4
Styrene SCHEMBL27256200 0.80 ALDH1A1 (0.42) LMNATSHRALDH1A1KDM4ECA2
SCHEMBL17627317 0.80 HTR2A (0.50) HTR2ALMNATSHRCTSCGRIK1
SCHEMBL27890557 0.80 HTR2A (0.50) HTR2ALMNATSHRCTSCGRIK1
SCHEMBL11000399 0.79 HTR2A (0.44) HTR2ALMNATSHR
SCHEMBL3447818 0.78 ALDH1A1 (0.40) HTR2ALMNATSHRALDH1A1KDM4E
Hydrochloric Acid SCHEMBL10994134 0.78 HTR2A (0.47) HTR2ALMNATSHR

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 20 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0768862-B1 PERSONAL CARE COMPOSITIONS CONTAINING THERMOPLASTIC ELASTOMERIC GRAFT COPOLYMERS PROCTER & GAMBLE (US) 2001-10-17 EP claimed
US-4068676-A RELEASE AGENTS HALLIBURTON COMPANY (US) 1978-01-17 US claimed
CN-108431220-B Polypeptides having beta-glucanase activity, polynucleotides encoding same and use thereof in cleaning and detergent compositions 诺维信公司 2022-06-07 CN disclosed
CN-103253022-A Flexographic printing plate precursor for laser engraving and process for producing same, and flexographic printing plate and process for making same FUJIFILM CORP 2013-08-21 CN disclosed
US-20080152430-A1 Drain System IMBIBITIVE TECHNOLOGIES CORPORATION 2008-06-26 US disclosed
EP-1851391-A2 DRAIN SYSTEM Imbibitive Technologies Corporation (US) 2007-11-07 EP disclosed
WO-2006084100-A2 DRAIN SYSTEM IMBIBITIVE TECHNOLOGIES CORPORATION (US) 2006-08-10 WO disclosed
EP-0334715-B1 FABRICATION PROCESS OF SHOCK RESISTANT VINYL AROMATIC RESIN DIRECTLY MADE FROM BUTADIEN ELF ATOCHEM S.A. (FR) 1993-05-26 EP disclosed
US-5162406-A Containing hydroxyphenylalkylenyl isocyanurate, polyphenylene diphosphonite and ackylidene bisphenol THE DOW CHEMICAL COMPANY (US) 1992-11-10 US disclosed
EP-0334715-A2 Fabrication process of shock resistant vinyl aromatic resin directly made from butadien ELF ATOCHEM S.A. (FR) 1989-09-27 EP disclosed
US-4620048-A POLYMER HAVE NARROW MOLECULAR WEIGHT DISTRIBUTION EXXON RESEARCH & ENGINEERING CO. (US) 1986-10-28 US disclosed
EP-0059231-B1 PREPARATION OF ALKENYL AROMATIC MONOMER BUTADIENE RUBBER AND PREPARATION OF IMPACT RESISTANT RESIN THEREFROM THE DOW CHEMICAL COMPANY (US) 1986-05-28 EP disclosed
US-4559389-A HIGH RESOLUTION AND DRY ETCHING RESISTANCE ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1985-12-17 US disclosed
US-4523000-A HIGH RESOLUTION, AND DRY ETCH RESISTANCE, SOLVENT SOLUBLE ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1985-06-11 US disclosed
EP-0118572-A1 A process for preparation of diene styrene alpha-methylstyrene block polymers and polymers therefrom THE DOW CHEMICAL COMPANY (US) 1984-09-19 EP disclosed
US-4427837-A Process for preparation of diene-styrene-α-methylstyrene block polymers and polymers therefrom THE DOW CHEMICAL COMPANY (US) 1984-01-24 US disclosed
US-4362849-A LITHIUM-BASED CATALYST THE DOW CHEMICAL COMPANY (US) 1982-12-07 US disclosed
EP-0059231-A1 Preparation of alkenyl aromatic monomer butadiene rubber and preparation of impact resistant resin therefrom THE DOW CHEMICAL COMPANY (US) 1982-09-08 EP disclosed
US-4311819-A Preparation of alkenyl aromatic monomer butadiene rubber THE DOW CHEMICAL COMPANY (US) 1982-01-19 US disclosed
US-4068676-A RELEASE AGENTS HALLIBURTON COMPANY (US) 1978-01-17 US disclosed