SCHEMBL28187759

SCHEMBL28187759

BrCc1ccc(/N=N/c2ccccc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.59
▸ TRPA1 O75762 2/20 0.59
▸ TSHR P16473 2/20 0.59
▸ MAPT P10636 7/20 0.50
▸ MEN1 O00255 6/20 0.50
▸ KMT2A Q03164 6/20 0.50
▸ RAB9A P51151 3/20 0.50
▸ HTT P42858 2/20 0.50
▸ NPC1 O15118 2/20 0.50
▸ PKM P14618 1/20 0.50
▸ CES2 O00748 1/20 0.47
▸ CES1 P23141 1/20 0.47
▸ TDP1 Q9NUW8 3/20 0.45
▸ MAPK1 P28482 2/20 0.45
▸ HSD17B10 Q99714 1/20 0.45
▸ KDM4E B2RXH2 2/20 0.42
▸ HSP90AA1 P07900 1/20 0.42
▸ POLB P06746 1/20 0.42
▸ CYP2D6 P10635 1/20 0.42
▸ PPARG P37231 2/20 0.41

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
SCHEMBL28233499 1.00 ALDH1A1 (0.59) ALDH1A1TRPA1TSHRMAPTMEN1
SCHEMBL15821556 0.90 ALDH1A1 (0.48) ALDH1A1TRPA1TSHRMAPTMEN1
SCHEMBL9822956 0.90 ALDH1A1 (0.48) ALDH1A1TRPA1TSHRMAPTMEN1
SCHEMBL31396820 0.80 ALDH1A1 (0.52) ALDH1A1TRPA1TSHRMAPTMEN1
SCHEMBL13278246 0.80 ALDH1A1 (0.63) ALDH1A1TRPA1TSHRMAPTMEN1
SCHEMBL13278248 0.80 ALDH1A1 (0.63) ALDH1A1TRPA1TSHRMAPTMEN1
SCHEMBL90893 0.79 ALDH1A1 (0.92) ALDH1A1TRPA1TSHRMAPTMEN1
SCHEMBL9418780 0.79 ALDH1A1 (0.92) ALDH1A1TRPA1TSHRMAPTMEN1
SCHEMBL21023910 0.79 ALDH1A1 (0.92) ALDH1A1TRPA1TSHRMAPTMEN1
SCHEMBL21024214 0.79 ALDH1A1 (0.92) ALDH1A1TRPA1TSHRMAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106215192-B A kind of pH and light double-bang firecracker answer target drug-carrying system and preparation method thereof 南京理工大学 2018-11-13 — — CN claimed
CN-107335383-A Soluble cation Gemini surfactant of the coupling link containing azobenzene and its preparation method and application 宁德师范学院 2017-11-10 — — CN claimed
CN-119161506-A Solid-phase probe for marking terminal alkyne compound and synthesis method and application thereof 中国科学院兰州化学物理研究所 2024-12-20 — — CN disclosed
CN-111072568-B Phenyl pyrazole compound containing azo structure, and preparation method and application thereof 华东理工大学 2024-07-23 — — CN disclosed
CN-110867270-B Preparation method and application of photoresponse conductive fluid 宁德师范学院 2021-04-30 — — CN disclosed
CN-108273478-B Formaldehyde removal composition and product 李怀玉 2021-03-02 — — CN disclosed
CN-111072568-A Phenylpyrazole compound containing azo structure as well as preparation method and application thereof 华东理工大学 2020-04-28 — — CN disclosed
CN-110867270-A Preparation method and application of photoresponse conductive fluid 宁德师范学院 2020-03-06 — — CN disclosed
CN-106215192-B A kind of pH and light double-bang firecracker answer target drug-carrying system and preparation method thereof 南京理工大学 2018-11-13 — — CN disclosed
CN-108273478-A A kind of formaldehyde removing composition and product 李怀玉 2018-07-13 — — CN disclosed
CN-107335383-A Soluble cation Gemini surfactant of the coupling link containing azobenzene and its preparation method and application 宁德师范学院 2017-11-10 — — CN disclosed
CN-107335383-A Soluble cation Gemini surfactant of the coupling link containing azobenzene and its preparation method and application 宁德师范学院 2017-11-10 — — CN disclosed
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