SCHEMBL11098338

SCHEMBL11098338

Brc1cccc2c1cc1ccc3cc4c5ccccc5cc5ccc6cc2c1c3c6c54

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 4/20 0.56
▸ ERBB2 P04626 1/20 0.56
▸ FYN P06241 1/20 0.56
▸ MAOA P21397 1/20 0.56
▸ ACHE P22303 1/20 0.56
▸ AHR P35869 1/20 0.56
▸ ALDH1A1 P00352 5/20 0.47
▸ HSD17B10 Q99714 5/20 0.47
▸ HPGD P15428 3/20 0.47
▸ HIF1A Q16665 2/20 0.47
▸ CYP1B1 Q16678 1/20 0.47
▸ THRB P10828 1/20 0.47
▸ HPRT1 P00492 3/20 0.40
▸ TSHR P16473 2/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ CASP1 P29466 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ TRPM4 Q8TD43 1/20 0.38
▸ CYP2A6 P11509 1/20 0.38
▸ TDP1 Q9NUW8 1/20 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
SCHEMBL6753557 0.85 CYP1A2 (0.55) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL27517 0.84 CYP1A2 (0.68) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL28132672 0.84 CYP1A2 (0.68) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL29562937 0.84 CYP1A2 (0.68) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL83656 0.83 CYP1A2 (0.53) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL4854644 0.83 CYP1A2 (0.80) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL4852526 0.81 CYP1A2 (0.71) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL4849366 0.81 CYP1A2 (0.64) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL4849434 0.81 CYP1A2 (0.70) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL4853901 0.81 CYP1A2 (0.77) CYP1A2ERBB2FYNMAOAACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111556882-B Polymer additives for reducing viscosity loss upon tinting 巴斯夫欧洲公司 2022-10-04 — — CN disclosed
CN-109983042-B Latex polymers 惠普发展公司,有限责任合伙企业 2021-10-12 — — CN disclosed
CN-111556882-A Polymer additives for reducing viscosity loss during tinting 巴斯夫欧洲公司 2020-08-18 — — CN disclosed
CN-109983042-A Latex polymers 惠普发展公司,有限责任合伙企业 2019-07-05 — — CN disclosed
CN-103958615-B Polymer-bound vat dyestuffs 锡克拜控股有限公司 2017-09-12 — — CN disclosed
CN-103770491-B Ink jet printing ink and printing process MIMAKI ENGINEERING CO., LTD. (JP) 2016-02-03 — — CN disclosed
CN-102985493-B modified pigment CABOT CORP. (US) 2015-11-25 — — CN disclosed
CN-103958615-A Polymer bonded vat dyes SICPA HOLDING SA 2014-07-30 — — CN disclosed
CN-103770491-A Ink-jet printing ink and printing method MIMAKI ENG KK 2014-05-07 — — CN disclosed
CN-102985493-A Modified pigments CABOT CORP 2013-03-20 — — CN disclosed
CN-101321835-B Recording ink, recording ink set, records, ink cartridge, recording method, and inkjet recording apparatus RICOH CO LTD 2011-10-12 — — CN disclosed
CN-101821341-A Tinting pigment through modification CABOT CORP 2010-09-01 — — CN disclosed
CN-100519667-C Modified pigment products and black matrixes comprising same CABOT CORP (US) 2009-07-29 — — CN disclosed
CN-101321835-A Recording ink, recording ink set, records, ink cartridge, recording method, and inkjet recording apparatus RICOH KK (JP) 2008-12-10 — — CN disclosed
CN-1703467-A Modified pigment products and black substrates comprising the same CABOT CORP (US) 2005-11-30 — — CN disclosed
US-4459233-A Purification of crude organic pigments BASF AKTIENGESELLSCHAFT (DE) 1984-07-10 — — US disclosed
US-4405785-A Vat dyestuff prepared from crude anthraquinone mixtures TOMS RIVER CHEMICAL CORPORATION (US) 1983-09-20 — — US disclosed
Send feedback