Aniline

Aniline

SCHEMBL11796445

NS(=O)(=O)c1cc(C(=O)O)cc(NCC2CC2)c1S.Nc1ccccc1

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 2/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ USP2 O75604 2/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ LMNA P02545 2/20 0.41
▸ HPGD P15428 2/20 0.41
▸ HIF1A Q16665 2/20 0.41
▸ HSD17B10 Q99714 2/20 0.41
▸ TSHR P16473 1/20 0.41
▸ BLM P54132 1/20 0.41
▸ SLC12A2 P55011 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ VCP P55072 2/20 0.39
▸ CREBBP Q92793 3/20 0.38
▸ PTGER4 P35408 2/20 0.37
▸ LIPC P11150 1/20 0.37
▸ LIPG Q9Y5X9 1/20 0.37
▸ KDM4C Q9H3R0 1/20 0.36
▸ NSD2 O96028 1/20 0.36
▸ CNR2 P34972 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
Acetanilide SCHEMBL11797057 0.87 CA2 (0.41) CA2KDM4EUSP2ALDH1A1LMNA
Aniline SCHEMBL11796628 0.83 CISD1 (0.52) CA2KDM4EUSP2ALDH1A1LMNA
Aniline SCHEMBL11809275 0.81 CA2 (0.44) CA2KDM4EUSP2ALDH1A1LMNA
SCHEMBL11787527 0.81 CA2 (0.43) CA2KDM4EUSP2ALDH1A1LMNA
Aniline SCHEMBL11799685 0.80 CA2 (0.44) CA2KDM4EUSP2ALDH1A1LMNA
Aniline SCHEMBL11806717 0.80 CA2 (0.43) CA2KDM4EUSP2ALDH1A1LMNA
SCHEMBL11791772 0.79 CA2 (0.42) CA2KDM4EUSP2ALDH1A1LMNA
Aniline SCHEMBL11801565 0.79 CA2 (0.40) CA2KDM4EUSP2ALDH1A1LMNA
SCHEMBL11784558 0.79 KDM4E (0.57) CA2KDM4EUSP2ALDH1A1LMNA
SCHEMBL11796436 0.79 KDM4C (0.37) CA2KDM4EUSP2ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3992440-A DIURETICS CIBA-GEIGY CORPORATION (US) 1976-11-16 — — US disclosed
US-3982018-A DIURETICS CIBA-GEIGY CORPORATION (US) 1976-09-21 — — US disclosed
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