4-Nitroaniline

4-Nitroaniline

SCHEMBL3978656

Nc1ccc([N+](=O)[O-])cc1.O=C(CCl)Nc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.61

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.56
MEN1 O00255 4/20 0.56
KMT2A Q03164 4/20 0.56
MAPT P10636 4/20 0.56
HTT P42858 3/20 0.56
LMNA P02545 3/20 0.52
PRMT1 Q99873 1/20 0.51
HSP90AA1 P07900 1/20 0.51
SMN1; SMN2 Q16637 2/20 0.50
HPGD P15428 1/20 0.50
HDAC1 Q13547 1/20 0.49
POLB P06746 3/20 0.49

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
SCHEMBL853676 0.92 MEN1 (0.65) ALDH1A1MEN1KMT2AMAPTHTT
SCHEMBL1707504 0.85 RAB9A (0.63) ALDH1A1MEN1KMT2AMAPTHTT
SCHEMBL23748585 0.84 MEN1 (0.70) ALDH1A1MEN1KMT2AMAPTHTT
SCHEMBL10923174 0.84 NPSR1 (0.73) ALDH1A1MEN1KMT2AMAPTHTT
SCHEMBL1311708 0.82 MEN1 (0.82) ALDH1A1MEN1KMT2AMAPTLMNA
SCHEMBL6407959 0.81 MEN1 (0.59) ALDH1A1MEN1KMT2AMAPTHTT
SCHEMBL31633419 0.81 ALDH1A1 (0.56) ALDH1A1MEN1KMT2AMAPTHTT
SCHEMBL9018657 0.80 MEN1 (0.71) ALDH1A1MEN1KMT2AMAPTHTT
SCHEMBL1429699 0.80 MEN1 (0.65) ALDH1A1MEN1KMT2AMAPTHTT
SCHEMBL3677488 0.79 MEN1 (0.65) ALDH1A1MEN1KMT2AMAPTHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1907385-A4 COMPOUNDS SMITHKLINE BEECHAM CORP (US) 2009-05-06 EP disclosed
EP-1907385-A2 COMPOUNDS SmithKline Beecham Corporation (US) 2008-04-09 EP disclosed
WO-2007018941-A2 PYRIMIDYL-THIOPHENE DERIVATIVES SMITHKLINE BEECHAM CORPORATION (US) 2007-02-15 WO disclosed