Aniline

Aniline

SCHEMBL7901181

Nc1ccccc1.O=C(Nc1ccc(C(=O)O)cc1O)Nc1ccccc1Br

nearest known ligand 0.63

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CXCR1 P25024 9/20 0.63
CXCR2 P25025 11/20 0.60
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
TDP1 Q9NUW8 1/20 0.55
HDAC6 Q9UBN7 1/20 0.55
HTT P42858 3/20 0.51
NPC1 O15118 2/20 0.51
LMNA P02545 2/20 0.51
RAB9A P51151 2/20 0.51
GRIK1 P39086 1/20 0.48
GAA P10253 1/20 0.46
MAPT P10636 1/20 0.46
CASP3 P42574 1/20 0.46
SENP8 Q96LD8 1/20 0.46
SENP7 Q9BQF6 1/20 0.46
SENP6 Q9GZR1 1/20 0.46
PYGL P06737 2/20 0.44
KDM5A P29375 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL7896676 0.84 CXCR1 (0.57) CXCR1CXCR2MEN1KMT2ATDP1
SCHEMBL5595168 0.84 CXCR1 (0.69) CXCR1CXCR2MEN1KMT2ATDP1
SCHEMBL5595211 0.83 CXCR1 (0.64) CXCR1CXCR2MEN1KMT2ATDP1
SCHEMBL7489633 0.82 CXCR1 (0.66) CXCR1CXCR2MEN1KMT2ATDP1
SCHEMBL5594648 0.79 CXCR1 (0.66) CXCR1CXCR2MEN1KMT2ATDP1
SCHEMBL5595020 0.78 CXCR2 (0.68) CXCR1CXCR2MEN1KMT2AHTT
SCHEMBL7896679 0.78 RAB9A (0.59) CXCR1CXCR2MEN1KMT2ATDP1
SCHEMBL5595143 0.77 CXCR1 (0.71) CXCR1CXCR2MEN1KMT2ATDP1
SCHEMBL7490438 0.77 CXCR1 (0.59) CXCR1CXCR2MEN1KMT2ATDP1
SCHEMBL5595039 0.77 CXCR1 (0.59) CXCR1CXCR2MEN1KMT2ATDP1

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-6180675-B1 THERAPY FOR CHEMOKINE SENSITIVE DISEASE; USING A AROMATIC (THIO)UREA COMPOUND SMITHKLINE BEECHAM CORPORATION 2001-01-30 US disclosed