SCHEMBL17469595

SCHEMBL17469595

Cc1ccc(-c2ccc(-c3ccc(I)cc3)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 5/20 0.50
TDP1 Q9NUW8 1/20 0.50
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
HPGD P15428 1/20 0.42
ALOX15 P16050 1/20 0.42
CYP2C19 P33261 1/20 0.42
HSD17B10 Q99714 1/20 0.42
ALDH1A1 P00352 2/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38
ENPP3 O14638 1/20 0.38
ENPP1 P22413 1/20 0.38
KIF11 P52732 1/20 0.38
PTGS2 P35354 1/20 0.38
MCL1 Q07820 1/20 0.35
RAPGEF4 Q8WZA2 1/20 0.35
TSHR P16473 3/20 0.35

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
SCHEMBL19004134 1.00 ACHE (0.50) ACHETDP1CYP2D6CYP2C9HPGD
SCHEMBL4392845 1.00 ACHE (0.50) ACHETDP1CYP2D6CYP2C9HPGD
SCHEMBL10068159 0.92 ACHE (0.42) ACHETDP1CYP2D6CYP2C9HPGD
SCHEMBL158 0.90
SCHEMBL2757577 0.90
SCHEMBL17078009 0.87
Bromide SCHEMBL3346674 0.87
Ammonia Solution, Strong SCHEMBL11574766 0.87
Fluoride SCHEMBL752726 0.87 ACHE (0.57) ACHETDP1ALDH1A1CA1CA2
SCHEMBL10634092 0.87

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021135725-A1 ORGANIC COMPOUND, ELECTRONIC DEVICE AND ELECTRONIC APPARATUS USING SAME 陕西莱特光电材料股份有限公司 2021-07-08 WO disclosed
WO-2021085279-A1 LIQUID CRYSTAL COMPOSITION, LIQUID CRYSTAL ELEMENT, SENSOR, LIQUID CRYSTAL LENS, OPTICAL COMMUNICATION DEVICE, AND ANTENNA DIC株式会社 2021-05-06 WO disclosed
EP-3010068-B1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO LTD (KR) 2020-12-09 EP disclosed
US-9957441-B2 Amine-based compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2018-05-01 US disclosed
US-9960359-B2 Arylamine-based compound and organic light emitting diode comprising the same SAMSUNG DISPLAY CO., LTD. (KR) 2018-05-01 US disclosed
US-9773987-B2 Silicon-based compound and organic light-emitting diode comprising the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-09-26 US disclosed
WO-2016013732-A1 COMPOSITION FOR ORGANIC OPTOELECTRIC DIODE, ORGANIC OPTOELECTRIC DIODE, AND DISPLAY DEVICE 삼성에스디아이 주식회사 2016-01-28 WO disclosed