Sulfuric Acid

Sulfuric Acid

SCHEMBL4456717

C=C(C)C(=O)Nc1ncc(NC(=O)C(=C)C)c(NC(=O)C(=C)C)n1.O=S(=O)(O)O

nearest known ligand 0.33

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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
▸ JAK3 P52333 3/20 0.33
▸ MAPT P10636 4/20 0.33
▸ BTK Q06187 1/20 0.33
▸ RXFP1 Q9HBX9 1/20 0.33
▸ FGFR1 P11362 1/20 0.32
▸ FGFR4 P22455 1/20 0.32
▸ TDP1 Q9NUW8 2/20 0.32
▸ SYK P43405 2/20 0.31
▸ EGFR P00533 2/20 0.31
▸ MET P08581 1/20 0.31
▸ ALK Q9UM73 1/20 0.31
▸ TP53 P04637 1/20 0.31
▸ MEN1 O00255 2/20 0.30
▸ KMT2A Q03164 2/20 0.30
▸ CYP1A2 P05177 1/20 0.30
▸ CYP3A4 P08684 1/20 0.30
▸ CYP2C9 P11712 1/20 0.30
▸ CYP2C19 P33261 1/20 0.30
▸ MCL1 Q07820 1/20 0.30
▸ PTK2B Q14289 1/20 0.30

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
Sulfuric Acid SCHEMBL4461982 0.79 MAPK3 (0.36) FGFR4EGFRMAPK1MAPK3
Sulfuric Acid SCHEMBL5242033 0.74 HTT (0.49) MAPTRXFP1TDP1KMT2APOLB
Sulfuric Acid SCHEMBL5244029 0.72 MAPK3 (0.41) EGFRMAPK1MAPK3
SCHEMBL4461476 0.69 RXFP1 (0.42) MAPTRXFP1TDP1KMT2ACYP1A2
SCHEMBL8079170 0.67 HTT (0.55) MAPTRXFP1TDP1KMT2AL3MBTL1
SCHEMBL28269774 0.66 L3MBTL1 (0.49) MAPTTDP1MEN1KMT2ACYP2C9
SCHEMBL5833719 0.65 LMNA (0.43) MAPTRXFP1TDP1KMT2ACYP1A2
SCHEMBL24313998 0.63 RXFP1 (0.38) MAPTRXFP1TDP1KMT2ACYP1A2
SCHEMBL7515186 0.63 TDP1 (0.36) JAK3MAPTBTKRXFP1TDP1
SCHEMBL1813599 0.63 NPC1 (0.46) MAPTRXFP1TDP1ALDH1A1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1828253-A1 INCLUSION COMPLEXES OF UNSATURATED MONOMERS, THEIR POLYMERS AND PROCESS FOR PREPARATION THEREOF COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2007-09-05 — — EP claimed
US-20060094844-A1 Inclusion complexes of unsaturated monomers, their polymers and process for preparation thereof COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH 2006-05-04 — — US claimed
WO-2006046255-A1 INCLUSION COMPLEXES OF UNSATURATED MONOMERS, THEIR POLYMERS AND PROCESS FOR PREPARATION THEREOF COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2006-05-04 — — WO claimed
US-7560522-B2 Inclusion complexes of unsaturated monomers, their polymers and process for preparation thereof COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2009-07-14 — — US disclosed
US-20070213489-A1 Inclusion complexes of unsaturated monomers, their polymers and process for preparation thereof PATIL PRERANA M 2007-09-13 — — US disclosed
EP-1828253-A1 INCLUSION COMPLEXES OF UNSATURATED MONOMERS, THEIR POLYMERS AND PROCESS FOR PREPARATION THEREOF COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2007-09-05 — — EP disclosed
EP-1828255-A1 WATER SOLUBLE POLYMERS CONTAINING VINYL UNSATURATION, THEIR CROSSLINKING AND PROCESS FOR PREPARATION THEREOF COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2007-09-05 — — EP disclosed
WO-2006046254-A1 WATER SOLUBLE POLYMERS CONTAINING VINYL UNSATURATION, THEIR CROSSLINKING AND PROCESS FOR PREPARATION THEREOF COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2006-05-04 — — WO disclosed
WO-2006046255-A1 INCLUSION COMPLEXES OF UNSATURATED MONOMERS, THEIR POLYMERS AND PROCESS FOR PREPARATION THEREOF COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2006-05-04 — — WO disclosed
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