Aniline

Aniline

SCHEMBL10525035

Nc1ccc(N)c([N+](=O)[O-])c1N.Nc1ccccc1

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.47
LMNA P02545 3/20 0.45
TSHR P16473 2/20 0.42
TDP1 Q9NUW8 5/20 0.41
CYP3A4 P08684 2/20 0.41
ALOX15 P16050 1/20 0.41
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
USP2 O75604 1/20 0.41
KEAP1 Q14145 1/20 0.41
NFE2L2 Q16236 1/20 0.41
MAPT P10636 4/20 0.39
GFER P55789 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.37
POLB P06746 1/20 0.37
CASP3 P42574 1/20 0.37
SENP8 Q96LD8 1/20 0.37
SENP7 Q9BQF6 1/20 0.37
SENP6 Q9GZR1 1/20 0.37

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
SCHEMBL30488438 0.88 MEN1 (0.48) ALDH1A1LMNATSHRTDP1CYP3A4
SCHEMBL6048769 0.88 MEN1 (0.48) ALDH1A1LMNATSHRTDP1CYP3A4
SCHEMBL6011656 0.78 ALDH1A1 (0.47) ALDH1A1LMNATDP1CYP3A4MEN1
SCHEMBL27458439 0.78 ALDH1A1 (0.47) ALDH1A1LMNATDP1CYP3A4MEN1
Nitrobenzene SCHEMBL718033 0.77 ALDH1A1 (0.76) ALDH1A1LMNATSHRTDP1MEN1
Aniline SCHEMBL4155229 0.77 TSHR (0.42) ALDH1A1LMNATSHRTDP1MAPT
SCHEMBL27832802 0.76 MEN1 (0.53) ALDH1A1LMNATSHRTDP1CYP3A4
Aniline SCHEMBL4189701 0.74 TSHR (0.55) ALDH1A1TSHRTDP1CYP3A4ALOX15
SCHEMBL6155901 0.74 MAPT (0.40) ALDH1A1LMNAMEN1KMT2AMAPT
SCHEMBL597745 0.74 ALDH1A1 (0.50) ALDH1A1LMNATSHRTDP1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4841033-A Reactive red monoazo dye compound having two vinylsulfone type fiber reactive groups SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1989-06-20 US disclosed