Sulfuric Acid

Sulfuric Acid

SCHEMBL8551754

CCCCc1sc2ccc(NC(=O)c3ccc(C(C)C)cc3)cc2c1CCN(C)Cc1ccccc1.O=S(=O)(O)O

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

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 16)

geneUniProtsupporting neighboursconfidence
TMEM97 Q5BJF2 4/20 0.43
SIGMAR1 Q99720 4/20 0.43
MAPT P10636 3/20 0.40
LMNA P02545 2/20 0.40
TP53 P04637 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
MCHR1 Q99705 2/20 0.40
TRPV1 Q8NER1 1/20 0.39
HDAC1 Q13547 1/20 0.38
ACKR3 P25106 1/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
KDM4E B2RXH2 1/20 0.38
GALR3 O60755 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
AKT1 P31749 1/20 0.37

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
SCHEMBL8551441 0.87 ACKR3 (0.49) TMEM97SIGMAR1MAPTMCHR1TRPV1
Sulfuric Acid SCHEMBL8552469 0.84 TMEM97 (0.42) TMEM97SIGMAR1MAPTLMNATP53
Sulfuric Acid SCHEMBL8191182 0.84 HTR1F (0.43) TMEM97SIGMAR1MAPTLMNATP53
SCHEMBL8550328 0.71 FLT1 (0.37) MAPTTP53MCHR1HDAC1ACKR3
SCHEMBL8183280 0.70 HTR1F (0.57) TMEM97SIGMAR1MAPTMCHR1TRPV1
SCHEMBL8551588 0.70 TMEM97 (0.48) TMEM97SIGMAR1MAPTTP53MCHR1
SCHEMBL8551502 0.70 HTR1F (0.46) MAPTTP53RXFP1NPC1RAB9A
SCHEMBL8548549 0.65 HTR1F (0.50) TMEM97SIGMAR1MAPTTP53MCHR1
SCHEMBL10886251 0.62 HDAC6 (0.63) LMNAHDAC1NPC1RAB9AKDM4E
SCHEMBL8551891 0.61 HTR1F (0.49) MAPTTP53RXFP1HDAC1ACKR3

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
EP-0835869-A2 New serotonin 5-HT1F agonists ELI LILLY AND COMPANY (US) 1998-04-15 EP disclosed