Aniline

Aniline

SCHEMBL4259209

NOC(=O)c1ccc(-c2ccccc2)cc1.Nc1ccccc1

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.53
PDCD1 Q15116 1/20 0.51
CD274 Q9NZQ7 1/20 0.51
CYP3A4 P08684 1/20 0.50
TAAR1 Q96RJ0 1/20 0.50
HSD17B10 Q99714 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
SLC1A5 Q15758 1/20 0.49
SMN1; SMN2 Q16637 4/20 0.49
MAPT P10636 2/20 0.47
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
SCN1A P35498 1/20 0.45
SCN2A Q99250 1/20 0.45
SCN3A Q9NY46 1/20 0.45
HDAC1 Q13547 1/20 0.44
CTDSP1 Q9GZU7 1/20 0.44
EGFR P00533 1/20 0.44
SETD7 Q8WTS6 1/20 0.43
PRMT1 Q99873 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
SCHEMBL28036717 0.92 KDM4E (0.59) KDM4EPDCD1CD274SLC1A5SMN1; SMN2
Aniline SCHEMBL15936355 0.88 LMNA (0.54) CYP3A4HSD17B10TDP1SMN1; SMN2MAPT
SCHEMBL13310823 0.84 CA12 (0.47) KDM4EPDCD1CD274TDP1SLC1A5
Aniline SCHEMBL4252018 0.84 NPC1 (0.50) CYP3A4TDP1SMN1; SMN2NPC1RAB9A
Aniline SCHEMBL4256412 0.84 CES2 (0.50) TAAR1SMN1; SMN2MAPTNPC1RAB9A
SCHEMBL1000847 0.82 LMNA (0.57) CYP3A4TDP1MAPTNPC1RAB9A
Aniline SCHEMBL4258488 0.81 CES2 (0.56) KDM4ECYP3A4TDP1SMN1; SMN2MAPT
SCHEMBL15120801 0.80 BCL2L1 (0.54) KDM4EPDCD1CD274HSD17B10EGFR
SCHEMBL72340 0.80 LMNA (0.64) KDM4ECYP3A4HSD17B10TDP1SMN1; SMN2
SCHEMBL9138584 0.78 LMNA (0.61) KDM4ECYP3A4HSD17B10TDP1SMN1; 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1745022-B1 HISTONE DEACETYLASE INHIBITOR PRODRUGS ATON PHARMA INC (US) 2014-08-13 EP claimed
US-8227636-B2 Histone deacetylase inhibitor prodrugs MERCK HDAC RESEARCH, LLC (US) 2012-07-24 US claimed
EP-1745022-B1 HISTONE DEACETYLASE INHIBITOR PRODRUGS ATON PHARMA INC (US) 2014-08-13 EP disclosed
US-8227636-B2 Histone deacetylase inhibitor prodrugs MERCK HDAC RESEARCH, LLC (US) 2012-07-24 US disclosed
US-20090023786-A1 Histone Deacetylase Inhibitor Prodrugs ALTON PHARMA, INC. (US) 2009-01-22 US disclosed
EP-1745022-A1 HISTONE DEACETYLASE INHIBITOR PRODRUGS Aton Pharma, Inc. (US) 2007-01-24 EP disclosed
WO-2005097747-A1 HISTONE DEACETYLASE INHIBITOR PRODRUGS ATON PHARMA, INC. (US) 2005-10-20 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090023786-A1 Histone Deacetylase Inhibitor Prodrugs HDAC1, HDAC5, HDAC7 KDM4E 581/4885PDCD1 1129/4885CD274 1913/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.