SCHEMBL29025294

SCHEMBL29025294

[O]CCCCc1cccc(Cl)c1Cl

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TAAR1 Q96RJ0 2/20 0.57
▸ PNMT P11086 1/20 0.52
▸ IDO1 P14902 2/20 0.46
▸ KDM4E B2RXH2 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ FAAH O00519 1/20 0.40
▸ CYP2A13 Q16696 2/20 0.39
▸ CYP1A2 P05177 1/20 0.38
▸ GLA P06280 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ CYP2D6 P10635 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ RECQL P46063 1/20 0.36
▸ CTSG P08311 1/20 0.36
▸ CMA1 P23946 1/20 0.36
▸ DBH P09172 1/20 0.36

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
SCHEMBL10690855 0.85 TAAR1 (0.63) TAAR1PNMTIDO1KDM4EALDH1A1
SCHEMBL1804677 0.83 TAAR1 (0.54) TAAR1PNMTIDO1SMN1; SMN2
SCHEMBL7037671 0.82 TAAR1 (0.52) TAAR1PNMTIDO1
SCHEMBL15352399 0.81 CYP1A2 (0.48) TAAR1PNMTKDM4EALDH1A1CYP1A2
SCHEMBL1832372 0.80 TAAR1 (0.74) TAAR1PNMTIDO1KDM4EALDH1A1
SCHEMBL6680624 0.80 TAAR1 (0.57) TAAR1PNMTIDO1KDM4EALDH1A1
SCHEMBL15353519 0.79 CYP1A2 (0.46) TAAR1PNMTKDM4EALDH1A1CYP1A2
SCHEMBL15352087 0.79 CYP1A2 (0.46) TAAR1PNMTKDM4EALDH1A1CYP1A2
SCHEMBL8772436 0.78 TAAR1 (0.71) TAAR1PNMTIDO1KDM4EALDH1A1
SCHEMBL5701276 0.78 TAAR1 (0.55) TAAR1PNMTIDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118201913-A Process for producing 2-heteroarylpyridine compound 日本曹达株式会社 2024-06-14 — — CN disclosed
CN-118139853-A Process for producing 2-heteroarylpyridine compound 日本曹达株式会社 2024-06-04 — — CN disclosed
CN-118103353-A Process for producing 2-alkylthio-1-imidazolylethanone compound 日本曹达株式会社 2024-05-28 — — CN disclosed
CN-118103354-A Process for producing halogenated vinylimidazole compound 日本曹达株式会社 2024-05-28 — — CN disclosed
CN-112771034-B Heteroaryl azole compound and pest control agent 日本曹达株式会社 2024-02-09 — — CN disclosed
CN-114401633-B Method for pest control, pest control composition, and pest control kit 日本曹达株式会社 2023-12-12 — — CN disclosed
CN-111465596-B Pyridinium salt and pest control agent 日本曹达株式会社 2023-09-22 — — CN disclosed
CN-116744790-A Methods, seeds and compositions for controlling insects in crops 日本曹达株式会社 2023-09-12 — — CN disclosed
CN-116368201-A Boron-containing compound, light-emitting material, and light-emitting element using same 国立大学法人九州大学 2023-06-30 — — CN disclosed
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