SCHEMBL4081568

SCHEMBL4081568

c1ccc(CN(CCN(Cc2ccccc2)Cc2ccccc2)Cc2ccccc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.55
ALDH1A1 P00352 3/20 0.55
TSHR P16473 2/20 0.55
HDAC3 O15379 2/20 0.50
HDAC1 Q13547 2/20 0.50
HDAC2 Q92769 2/20 0.50
HDAC8 Q9BY41 2/20 0.50
NCOR2 Q9Y618 2/20 0.50
CALM1 P0DP23 1/20 0.50
CAMKK2 Q96RR4 1/20 0.50
CNR2 P34972 1/20 0.50
AOC3 Q16853 1/20 0.50
TRPM8 Q7Z2W7 1/20 0.48
TRPV1 Q8NER1 1/20 0.48
OPRM1 P35372 2/20 0.48
OPRD1 P41143 2/20 0.48
OPRK1 P41145 2/20 0.48
CARM1 Q86X55 1/20 0.48
PRMT6 Q96LA8 1/20 0.48
PRMT8 Q9NR22 1/20 0.48

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
SCHEMBL19326604 0.97 HTT (0.53) HTTALDH1A1TSHRHDAC3HDAC1
SCHEMBL9329761 0.97 HTT (0.53) HTTALDH1A1TSHRHDAC3HDAC1
SCHEMBL11795941 0.89 HDAC3 (0.56) HTTALDH1A1TSHRHDAC3HDAC1
SCHEMBL4974601 0.89 HDAC3 (0.61) HTTALDH1A1TSHRHDAC3HDAC1
SCHEMBL10039135 0.88 CNR2 (0.57) HTTALDH1A1TSHRCNR2OPRM1
SCHEMBL524817 0.88 CALM1 (0.65) HTTALDH1A1TSHRCALM1CAMKK2
SCHEMBL134524 0.88 TSHR (0.60) ALDH1A1TSHRCALM1CNR2AOC3
SCHEMBL2240248 0.87 TDP1 (0.50) HTTALDH1A1TSHRHDAC3HDAC1
SCHEMBL231061 0.87 OPRK1 (0.63) ALDH1A1TSHRAOC3TRPM8TRPV1
SCHEMBL11673147 0.87 HDAC3 (0.62) ALDH1A1TSHRHDAC3HDAC1HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112679431-A Method for preparing isoquinolone compound 上海迪赛诺化学制药有限公司 2021-04-20 CN claimed
EP-0383089-B1 Cold curing reactive resin blend and its use BAYER AG (DE) 1994-04-06 EP claimed
US-5084544-A Reaction of polyepoxides and polyisocyanates to form polyurethanes BAYER AKTIENGESELLSCHAFT (DE) 1992-01-28 US claimed
EP-0383089-A2 Cold curing reactive resin blend and its use BAYER AG (DE) 1990-08-22 EP claimed
EP-4217412-A1 WASTE MITIGATION METHODS AND MATERIALS Finite Research Ltd (GB) 2023-08-02 EP disclosed
WO-2022023916-A1 WASTE MITIGATION METHODS AND MATERIALS LI, Zhenzhen (CN) 2022-02-03 WO disclosed
US-20220025119-A1 WASTE MITIGATION METHODS AND MATERIALS LI SHENSHEN (US) 2022-01-27 US disclosed
CN-112679431-A Method for preparing isoquinolone compound 上海迪赛诺化学制药有限公司 2021-04-20 CN disclosed
CN-108558676-B Preparation method of N, N-dibenzylethylenediamine diacetate 四川武胜春瑞医药化工有限公司 2021-01-19 CN disclosed
CN-107091689-B Ultraviolet sensing layer coating liquid 富士胶片株式会社 2020-06-05 CN disclosed
US-10247603-B2 Ultraviolet-sensitive sheet, ultraviolet-sensing kit, and method for sensing ultraviolet FUJIFILM CORPORATION (JP) 2019-04-02 US disclosed
CN-106537103-B Ultraviolet light perception tablet, ultraviolet light perception set group and ultraviolet light cognitive method 富士胶片株式会社 2019-03-01 CN disclosed
EP-0374819-A1 Halo-derivative addition compounds Bromine Compounds Ltd. (IL) 1990-06-27 EP disclosed
US-4929530-A OXIDATIVE LEUCO DYES, PHOTO-OXIDIZERS, REDUCING AGENTS, ORGANIC SULFONAMIDES AND PHENOLIC COMPONENTS; EXPOSING TO LIGHT FUJI PHOTO FILM CO., LTD. (JP) 1990-05-29 US disclosed
US-4481373-A CATALYTIC OXIDATION OF OLEFINS IN PRESENCE OF TERTIARY AMINE OF AMIDE TOA NENRYO KOGYO KABUSHIKI KAISHA (JP) 1984-11-06 US disclosed
EP-0012587-B1 THERMO-SENSITIVE MULTI-COLOR RECORDING MATERIAL AND PROCESS FOR PREPARATION THEREOF Ricoh Company, Ltd (JP) 1983-05-25 EP disclosed
US-4311750-A DISCOLORING LAYER OF CROSSLINKING RESIN DISPOSED BETWEEN COLORING LAYERS RICOH COMPANY LIMITED (JP) 1982-01-19 US disclosed
EP-0012587-A1 Thermo-sensitive multi-color recording material and process for preparation thereof Ricoh Company, Ltd (JP) 1980-06-25 EP disclosed
US-4020232-A COATINGS OF AN AMINE DERIVATIVE AND A LEUCO DYE CAPABLE OF REACTING WITH SAID AMINE MITSUBISHI PAPER MILLS, LTD. (JA) 1977-04-26 US disclosed
US-3984605-A Heat sensitive recording material containing decolorizing agent MITSUBISHI PAPER MILLS, LTD. (JA) 1976-10-05 US disclosed