SCHEMBL15768897

SCHEMBL15768897

Ic1cccc2cc3cccc(I)c3cc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.40
CYP1A2 P05177 4/20 0.40
HSD17B10 Q99714 4/20 0.40
HPGD P15428 4/20 0.40
KDM4E B2RXH2 2/20 0.39
GAA P10253 1/20 0.39
ACHE P22303 2/20 0.38
ERBB2 P04626 1/20 0.38
FYN P06241 1/20 0.38
MAOA P21397 1/20 0.38
AHR P35869 1/20 0.38
NOS1 P29475 1/20 0.37
HIF1A Q16665 2/20 0.36
CYP1B1 Q16678 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
HTR2A P28223 1/20 0.36
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
GLA P06280 2/20 0.34
CYP2C19 P33261 1/20 0.34

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
SCHEMBL30838410 1.00 ALDH1A1 (0.40) ALDH1A1CYP1A2HSD17B10HPGDKDM4E
SCHEMBL16723362 0.92 ALDH1A1 (0.43) ALDH1A1CYP1A2HSD17B10HPGDKDM4E
SCHEMBL31108395 0.90 ALDH1A1 (0.50) ALDH1A1CYP1A2HSD17B10HPGDKDM4E
SCHEMBL4614015 0.90 ALDH1A1 (0.50) ALDH1A1CYP1A2HSD17B10HPGDKDM4E
SCHEMBL31072226 0.87 ALDH1A1 (0.48) ALDH1A1CYP1A2HSD17B10HPGDKDM4E
SCHEMBL30903863 0.87 ALDH1A1 (0.48) ALDH1A1CYP1A2HSD17B10HPGDKDM4E
SCHEMBL18649220 0.87 CYP1A2 (0.60) ALDH1A1CYP1A2HSD17B10HPGDKDM4E
SCHEMBL19802369 0.87 ALDH1A1 (0.60) ALDH1A1CYP1A2HSD17B10HPGDACHE
Formaldehyde SCHEMBL28561333 0.84 ALDH1A1 (0.50) ALDH1A1CYP1A2HSD17B10HPGDKDM4E
SCHEMBL11918712 0.80 CYP1A2 (0.43) ALDH1A1CYP1A2HSD17B10HPGDNOS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117843666-A Organic micromolecule containing boron-nitrogen covalent bond as well as preparation method and application thereof 中国计量大学 2024-04-09 CN disclosed
EP-3027555-B1 METHOD FOR EXFOLIATING GRAPHITE ASSISTED BY A DIELS-ALDER REACTION UNIV BORDEAUX (FR) 2023-05-24 EP disclosed
US-11530357-B2 Liquid crystal alignment agent and liquid crystal panel SHARP KABUSHIKI KAISHA (JP) 2022-12-20 US disclosed
US-11156873-B2 Alignment film, liquid crystal panel, and method for producing liquid crystal panel SHARP KABUSHIKI KAISHA (JP) 2021-10-26 US disclosed
US-10731062-B2 Gas-generating material and micropump SEKISUI CHEMICAL CO., LTD. (JP) 2020-08-04 US disclosed
US-20200208056-A1 LIQUID CRYSTAL ALIGNMENT AGENT AND LIQUID CRYSTAL PANEL SHARP KABUSHIKI KAISHA (JP) 2020-07-02 US disclosed
EP-2860167-B1 GAS GENERATING MATERIAL, AND MICROPUMP SEKISUI CHEMICAL CO LTD (JP) 2020-04-29 EP disclosed
US-20190106629-A1 LIQUID CRYSTAL DISPLAY DEVICE SHARP KABUSHIKI KAISHA (JP) 2019-04-11 US disclosed
US-20190079357-A1 ALIGNMENT FILM, LIQUID CRYSTAL PANEL, AND METHOD FOR PRODUCING LIQUID CRYSTAL PANEL SHARP KABUSHIKI KAISHA (JP) 2019-03-14 US disclosed
EP-2907798-B1 GAS-GENERATING MATERIAL AND MICROPUMP SEKISUI CHEMICAL CO LTD (JP) 2019-02-06 EP disclosed
CN-104350030-B Gas generating material and micropump 积水化学工业株式会社 2017-09-15 CN disclosed
US-9718692-B2 Method for exfoliating carbonaceous materials containing graphite, assisted by a Diels-Alder reaction UNIVERSITÉ DE BORDEAUX (FR) 2017-08-01 US disclosed
US-20160194207-A1 METHOD FOR EXFOLIATING CARBONACEAOUS MATERIALS CONTAINING GRAPHITE, ASSISTED BY A DIELS-ALDER REACTION INSTITUT POLYTECHNIQUE DE BORDEAUX (FR) 2016-07-07 US disclosed
US-20150232714-A1 GAS-GENERATING MATERIAL AND MICROPUMP SEKISUI CHEMICAL CO., LTD. (JP) 2015-08-20 US disclosed
EP-2907798-A1 GAS-GENERATING MATERIAL AND MICROPUMP Sekisui Chemical Co., Ltd. (JP) 2015-08-19 EP disclosed
EP-2860167-A1 GAS GENERATING MATERIAL, AND MICROPUMP Sekisui Chemical Co., Ltd. (JP) 2015-04-15 EP disclosed
US-8986630-B2 Gas-generating material and micro pump SEKISUI CHEMICAL CO., LTD. (JP) 2015-03-24 US disclosed
CN-104350030-A Gas-generating material and micropump SEKISUI CHEMICAL CO LTD 2015-02-11 CN disclosed
US-20140161687-A1 GAS-GENERATING MATERIAL AND MICRO PUMP SEKISUI CHEMICAL CO., LTD. (JP) 2014-06-12 US disclosed