Sulfuric Acid

Sulfuric Acid

SCHEMBL9190041

CC(C)(C)CC(C)(C)c1ccc(-c2ccccc2)c(-n2nc3ccccc3n2)c1.O=S(=O)(O)O

nearest known ligand 0.36

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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
PPARG P37231 1/20 0.36
PPARA Q07869 1/20 0.36
NPC1 O15118 5/20 0.34
RAB9A P51151 5/20 0.34
SMN1; SMN2 Q16637 4/20 0.34
LMNA P02545 2/20 0.34
CYP3A4 P08684 2/20 0.34
MAPK1 P28482 1/20 0.34
CASP3 P42574 1/20 0.34
ATM Q13315 1/20 0.34
SENP8 Q96LD8 1/20 0.34
SENP7 Q9BQF6 1/20 0.34
SENP6 Q9GZR1 1/20 0.34
SHBG P04278 1/20 0.33
ALDH1A1 P00352 3/20 0.32
KDM4E B2RXH2 3/20 0.32
HPGD P15428 2/20 0.32
MAPT P10636 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
POLB P06746 2/20 0.32

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 SCHEMBL9190036 0.86 CNR1 (0.47)
SCHEMBL9115616 0.85 NPC1 (0.36) PPARGPPARANPC1RAB9ASMN1; SMN2
SCHEMBL9006429 0.81 NPC1 (0.41) PPARGPPARANPC1RAB9ASMN1; SMN2
Benzene SCHEMBL9190034 0.81 NPC1 (0.41) PPARGPPARANPC1RAB9ASMN1; SMN2
Octrizole SCHEMBL15508 0.79 NPC1 (0.56) PPARGPPARANPC1RAB9ASMN1; SMN2
Octrizole SCHEMBL28983126 0.79 NPC1 (0.56) PPARGPPARANPC1RAB9ASMN1; SMN2
Octrizole SCHEMBL29349945 0.79 NPC1 (0.56) PPARGPPARANPC1RAB9ASMN1; SMN2
Octrizole SCHEMBL30315837 0.78 NPC1 (0.55) PPARGPPARANPC1RAB9ASMN1; SMN2
Octrizole SCHEMBL8614902 0.77 NPC1 (0.51) PPARGPPARANPC1RAB9ASMN1; SMN2
SCHEMBL7909025 0.76 NPC1 (0.46) PPARGPPARANPC1RAB9ASMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5466491-A Polymer substrate with curable coating and gelation inhibitor sensitive to radiation GENERAL ELECTRIC COMPANY (US) 1995-11-14 US disclosed