Aniline

Aniline

SCHEMBL28784816

C=CCC=O.Nc1ccccc1

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 4/20 0.50
▸ MAOB P27338 8/20 0.38
▸ MAOA P21397 7/20 0.38
▸ CYP19A1 P11511 2/20 0.38
▸ HSD17B10 Q99714 2/20 0.37
▸ CYP3A4 P08684 2/20 0.37
▸ TDP1 Q9NUW8 2/20 0.37
▸ TAAR1 Q96RJ0 1/20 0.37
▸ HTT P42858 2/20 0.36
▸ RAB9A P51151 2/20 0.35
▸ ALDH1A1 P00352 4/20 0.34
▸ CYP2C19 P33261 2/20 0.34
▸ MAPT P10636 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ CYP2D6 P10635 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ PKM P14618 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
Aniline SCHEMBL20516063 0.83 TSHR (0.58) TSHRMAOBMAOACYP19A1HSD17B10
Biphenyl SCHEMBL11290947 0.81 ALDH1A1 (0.45) TSHRTAAR1HTTRAB9AALDH1A1
Benzene SCHEMBL28317926 0.80 CYP2C19 (0.30) TSHRALDH1A1CYP2C19
Aniline SCHEMBL27409706 0.78 TSHR (0.58) TSHRMAOBMAOACYP19A1HSD17B10
Phenol SCHEMBL21433618 0.77 TDP1 (0.50) TSHRCYP3A4TDP1HTTALDH1A1
Bromobenzene SCHEMBL9418037 0.77 ALDH1A1 (0.50) TSHRMAOBMAOATDP1HTT
Aniline SCHEMBL28107375 0.76 TSHR (0.55) TSHRMAOBMAOACYP19A1HSD17B10
Aniline SCHEMBL27494361 0.76 TSHR (0.55) TSHRMAOBMAOACYP19A1HSD17B10
Aniline SCHEMBL4694521 0.76 TSHR (0.55) TSHRMAOBMAOACYP19A1HSD17B10
Aniline SCHEMBL28296543 0.76 TSHR (0.55) TSHRMAOBMAOACYP19A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112174793-B Method and ligand for breaking C-S bond of alpha-thioaryl ethanone compound 温州大学 2023-03-28 — — CN disclosed
CN-102298279-B Eletrophotographic photoconductor, process cartridge and image forming apparatus FUJI XEROX CO LTD 2014-12-10 — — CN disclosed
CN-101840168-B Electrophotographic photoreceptor, process cartridge, and image forming apparatus FUJI XEROX CO LTD 2014-05-21 — — CN disclosed
CN-102298279-A Eletrophotographic photoconductor, process cartridge and image forming apparatus — 2011-12-28 — — CN disclosed
CN-102298280-A Electrophotographic photoconductor, method for preparing the same, process cartridge, and image forming apparatus — 2011-12-28 — — CN disclosed
CN-101840168-A Electrophotographic photoreceptor, process cartridge, and image forming apparatus FUJI XEROX CO LTD 2010-09-22 — — CN disclosed
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