Sulfuric Acid

Sulfuric Acid

SCHEMBL8639591

Nc1ccc(N)c(F)c1.O=S(=O)(O)O

nearest known ligand 0.59

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Known targets — ChEMBL curated mechanism

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

The experimentally established mechanism targets of Sulfuric Acid. 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
ALDH1A1 P00352 7/20 0.59
TSHR P16473 3/20 0.59
HSD17B10 Q99714 3/20 0.59
THRB P10828 2/20 0.59
RECQL P46063 2/20 0.59
CYP3A4 P08684 2/20 0.59
ALOX15 P16050 2/20 0.59
HPGD P15428 1/20 0.59
CASP1 P29466 1/20 0.59
CA12 O43570 1/20 0.53
CA1 P00915 1/20 0.53
CA2 P00918 1/20 0.53
CA4 P22748 1/20 0.53
CA6 P23280 1/20 0.53
CA5A P35218 1/20 0.53
CA7 P43166 1/20 0.53
CA9 Q16790 1/20 0.53
CA14 Q9ULX7 1/20 0.53
CA5B Q9Y2D0 1/20 0.53
HDAC1 Q13547 1/20 0.44

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
SCHEMBL33738 0.86
SCHEMBL29415472 0.86
Fluoride SCHEMBL27668547 0.84 ALDH1A1 (0.59) ALDH1A1TSHRHSD17B10THRBRECQL
Hydrochloric Acid SCHEMBL8645112 0.84 ALDH1A1 (0.59) ALDH1A1TSHRHSD17B10THRBRECQL
Sulfuric Acid SCHEMBL6705350 0.83 ALDH1A1 (0.74) ALDH1A1TSHRHSD17B10THRBRECQL
Sulfuric Acid SCHEMBL34463729 0.83 ALDH1A1 (0.74) ALDH1A1TSHRHSD17B10THRBRECQL
SCHEMBL1266210 0.79 ALDH1A1 (0.54) ALDH1A1TSHRHSD17B10THRBRECQL
Sulfuric Acid SCHEMBL28433502 0.79 CA12 (0.50) ALDH1A1TSHRHSD17B10THRBRECQL
SCHEMBL5734698 0.77 CA1 (0.68) ALDH1A1TSHRHSD17B10CA12CA1
SCHEMBL3425338 0.77 RAPGEF4 (0.47) ALDH1A1TSHRHSD17B10THRBRECQL

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-5821320-A MIXING AROMATIC DIAMINE DIHYDROCHLORIDE OR SULFATE WITH AROMATIC ACID DIANHYDRIDE, HEATING TO DEHYDRATE AND CONDENSE PETROLEUM ENERGY CENTER (JP) 1998-10-13 US disclosed