SCHEMBL23714869

SCHEMBL23714869

Brc1ccc(N(c2ccc(Br)cc2)c2ccc(N(c3ccc(Br)cc3)c3ccc(Br)cc3)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 1/20 0.57
CA2 P00918 3/20 0.43
CA1 P00915 2/20 0.43
TSHR P16473 1/20 0.43
ALDH1A1 P00352 6/20 0.42
MAPK1 P28482 3/20 0.42
ALOX15 P16050 2/20 0.42
TDP1 Q9NUW8 3/20 0.39
MAPT P10636 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
KDM4E B2RXH2 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
CES2 O00748 1/20 0.36
CES1 P23141 1/20 0.36
TAAR1 Q96RJ0 2/20 0.35
HTR2A P28223 1/20 0.33

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
SCHEMBL67004 1.00 CYP2A6 (0.57) CYP2A6CA2CA1TSHRALDH1A1
SCHEMBL22502466 0.97 CYP2A6 (0.53) CYP2A6CA2CA1TSHRALDH1A1
Fluoride SCHEMBL31365993 0.97 CYP2A6 (0.53) CYP2A6CA2CA1TSHRALDH1A1
Hydrochloric Acid SCHEMBL1034657 0.94 CYP2A6 (0.50) CYP2A6CA2CA1TSHRALDH1A1
SCHEMBL12781545 0.91 ALDH1A1 (0.52) CYP2A6CA2CA1TSHRALDH1A1
SCHEMBL3794654 0.91 ALDH1A1 (0.52) CYP2A6CA2CA1TSHRALDH1A1
SCHEMBL24576 0.88 ALDH1A1 (0.56) CYP2A6CA2CA1TSHRALDH1A1
SCHEMBL7033150 0.88 ALDH1A1 (0.56) CYP2A6CA2CA1TSHRALDH1A1
SCHEMBL460304 0.88 ALDH1A1 (0.56) CYP2A6CA2CA1TSHRALDH1A1
SCHEMBL15687666 0.88 ALDH1A1 (0.56) CYP2A6CA2CA1TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-121574365-A Conjugated polymer electrode material, preparation method and application thereof in lithium ion battery 湖南大学 2026-02-27 CN claimed
CN-119569565-A Method for synthesizing 2, 5-dihydroxyterephthalic acid 杭州云上新材有限公司 2025-03-07 CN claimed
CN-121574365-A Conjugated polymer electrode material, preparation method and application thereof in lithium ion battery 湖南大学 2026-02-27 CN disclosed
CN-121574365-A Conjugated polymer electrode material, preparation method and application thereof in lithium ion battery 湖南大学 2026-02-27 CN disclosed
CN-121310784-A Perovskite solar cell and preparation method 南京大学 2026-01-09 CN disclosed
CN-119569565-A Method for synthesizing 2, 5-dihydroxyterephthalic acid 杭州云上新材有限公司 2025-03-07 CN disclosed
US-20220216415-A1 ORGANIC ELECTRONICS MATERIAL AND METHOD FOR PREPARING CHARGE-TRANSPORTING POLYMER SHOWA DENKO MATERIALS CO., LTD. (JP) 2022-07-07 US disclosed
EP-3859806-A1 ORGANIC ELECTRONIC MATERIAL AND ORGANIC ELECTRONIC ELEMENT Showa Denko Materials Co., Ltd. (JP) 2021-08-04 EP disclosed