Aniline

Aniline

SCHEMBL9280598

Nc1ccccc1.O=S(=O)([O-])[O-].O=S(O)O.[Na+].[Na+]

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

dacAdacBdacCftsImrcAmrcBmrdA

The experimentally established mechanism targets of Aniline. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.48
ALDH1A1 P00352 2/20 0.41
NT5E P21589 1/20 0.41
KMT2A Q03164 3/20 0.41
LMNA P02545 4/20 0.41
MEN1 O00255 2/20 0.41
CYP3A4 P08684 2/20 0.39
MPO P05164 1/20 0.39
CYP2C9 P11712 1/20 0.39
HTR6 P50406 1/20 0.39
TDP1 Q9NUW8 4/20 0.38
CA2 P00918 3/20 0.38
CA1 P00915 2/20 0.38
CA12 O43570 2/20 0.38
CA9 Q16790 2/20 0.38
AGO2 Q9UKV8 2/20 0.38
USP2 O75604 1/20 0.38
CA4 P22748 1/20 0.38
CA6 P23280 1/20 0.38
CA5A P35218 1/20 0.38

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 SCHEMBL8067192 0.89 TSHR (0.61) TSHRALDH1A1NT5EKMT2ALMNA
Aniline SCHEMBL11429513 0.86 TSHR (0.65) TSHRALDH1A1KMT2AMEN1CYP3A4
Aniline SCHEMBL11429518 0.86 TSHR (0.65) TSHRALDH1A1KMT2AMEN1CYP3A4
Aniline SCHEMBL5693989 0.84 TSHR (0.55) TSHRALDH1A1NT5EKMT2ALMNA
Aniline SCHEMBL28037885 0.84 TSHR (0.61) TSHRALDH1A1NT5EKMT2ALMNA
Aniline SCHEMBL5831365 0.79 TSHR (0.55) TSHRALDH1A1NT5EKMT2ALMNA
Questiomycin B SCHEMBL11559063 0.78 ALOX15 (0.58) TSHRALDH1A1KMT2ALMNAMEN1
Aniline SCHEMBL29494699 0.77 TSHR (0.58) TSHRALDH1A1KMT2AMEN1CYP3A4
Aniline SCHEMBL676147 0.76 TSHR (0.65) TSHRALDH1A1NT5EKMT2ALMNA
Aniline SCHEMBL167326 0.76 TSHR (0.65) TSHRALDH1A1NT5EKMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5460936-A With specific iodide content KONICA CORPORATION (JP) 1995-10-24 US disclosed
US-5310641-A Inner core, plurlity of outer shells substantially containing silver bromide or iodobromide; high speed, graininess, sharp, low fog density; astronomical, indoor, sports photography KONICA CORPORATION (JP) 1994-05-10 US disclosed
US-5221599-A SILVER HALIDE PHOTOGRAPHIC LIGHT SENSITIVE MATERIAL KONICA CORPORATION (JP) 1993-06-22 US disclosed
US-4990437-A With specific magenta coupler and core/shell silver halide grains KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) 1991-02-05 US disclosed