Aniline

Aniline

SCHEMBL10405488

C=C(c1ccccc1)c1ccccc1.CC(c1ccccc1)c1ccccc1.Nc1ccccc1

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ TSHR P16473 2/20 0.41
▸ LMNA P02545 3/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ NPSR1 Q6W5P4 2/20 0.39
▸ MAPT P10636 1/20 0.39
▸ XBP1 P17861 1/20 0.39
▸ ATM Q13315 1/20 0.39
▸ ADRA2C P18825 2/20 0.38
▸ ADRA2A P08913 1/20 0.38
▸ HIF1A Q16665 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ TAAR1 Q96RJ0 3/20 0.37
▸ CHRM2 P08172 1/20 0.36
▸ ADRA1A P35348 1/20 0.36
▸ RGS12 O14924 1/20 0.36
▸ GLA P06280 1/20 0.36
▸ CYP3A4 P08684 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
Aniline SCHEMBL28205031 0.84 TSHR (0.58) KMT2AMEN1TSHRLMNAMAPT
SCHEMBL4672030 0.78 TSHR (0.48) KMT2ATSHRLMNAMAPTADRA2C
SCHEMBL9823021 0.78 MEN1 (0.54) KMT2AMEN1TSHRLMNAMAPT
SCHEMBL6547367 0.76 MEN1 (0.53) KMT2AMEN1LMNASMN1; SMN2NPSR1
Hydrochloric Acid SCHEMBL10902755 0.76 KMT2A (0.52) KMT2AMEN1TSHRMAPTKDM4E
SCHEMBL16105765 0.76 KAT6A (0.47) KMT2AMEN1LMNASMN1; SMN2NPSR1
Dimethylamine SCHEMBL6342373 0.75 MEN1 (0.52) KMT2AMEN1TSHRLMNASMN1; SMN2
Hydrogen Peroxide SCHEMBL8846644 0.74 ESR1 (0.55) KMT2AMEN1TSHRLMNAADRA2C
SCHEMBL9148045 0.73 SMN1; SMN2 (0.47) KMT2AMEN1LMNASMN1; SMN2NPSR1
SCHEMBL9806376 0.73 TYR (0.42) KMT2AMEN1TSHRLMNASMN1; SMN2

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-4892973-A FROM CORRESPONDING ALKANE BY OXIDATION WITH LEAD PEROXIDE YAMADA CHEMICAL CO., LTD. (JP) 1990-01-09 — — US disclosed
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