Sulfuric Acid

Sulfuric Acid

SCHEMBL7104162

COc1cccc(NCCO)c1N.O=S(=O)(O)O

nearest known ligand 0.49

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3CALCRLCHRM1CHRM2CHRM3F2RMAOAMAOBMAP2K1MAP2K2NTRK1NTRK2NTRK3OPRD1OPRK1OPRM1P2RY12PKLRSCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASLC18A2SLC6A2SLC6A3TLR7TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8dacAdacBdacCfolAftsImrcAmrcBmrdApolrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmB1rpmB2rpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmHrpmIrpmJrpmJ2rpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsR1rpsR2rpsSrpsTrpsUrpsZykgMykgO

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
CHRM2 known ✓ P08172 1/20 0.42
ADRA1D known ✓ P25100 1/20 0.38
ADRA1A known ✓ P35348 1/20 0.38
ADRA1B known ✓ P35368 1/20 0.38
KDM4E B2RXH2 1/20 0.46
GLA P06280 1/20 0.46
NR1I2 O75469 1/20 0.42
AHR P35869 1/20 0.42
GSK3A P49840 1/20 0.42
GSK3B P49841 1/20 0.42
CDK5 Q00535 1/20 0.42
CDK5R1 Q15078 1/20 0.42
GBA1 P04062 2/20 0.41
TSHR P16473 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ALDH1A1 P00352 2/20 0.40
HSD17B10 Q99714 1/20 0.40
USP2 O75604 1/20 0.39
HTT P42858 1/20 0.39
RAD52 P43351 1/20 0.39

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
SCHEMBL2476416 0.93 KDM4E (0.47) KDM4EGLANR1I2AHRGSK3A
Sulfuric Acid SCHEMBL4244724 0.85 CHRM2 (0.58) KDM4EGLANR1I2AHRGSK3A
SCHEMBL20837291 0.77 NCF1 (0.44) KDM4ECHRM2L3MBTL1ALDH1A1HSD17B10
Sulfuric Acid SCHEMBL9680698 0.77 GAA (0.43) KDM4EGLACHRM2TSHRALDH1A1
SCHEMBL2219253 0.77 CHRM2 (0.51) KDM4ECHRM2L3MBTL1ALDH1A1HSD17B10
SCHEMBL3073595 0.76 CHRM2 (0.62) KDM4EGLANR1I2AHRGSK3A
Sulfuric Acid SCHEMBL7104156 0.75 CA1 (0.43) L3MBTL1ALDH1A1MEN1KMT2AGAA
SCHEMBL27982786 0.75 TSHR (0.55) KDM4EGLACHRM2GBA1TSHR
SCHEMBL20232562 0.75 ALDH1A1 (0.42) KDM4ECHRM2L3MBTL1ALDH1A1HSD17B10
SCHEMBL20837292 0.75 SMN1; SMN2 (0.46) KDM4EALDH1A1HSD17B10MEN1KMT2A

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
EP-4229165-A1 A SYNERGISTIC PERFUMING COMPOSITION Firmenich SA (CH) 2023-08-23 EP disclosed
WO-2022129351-A1 A SYNERGISTIC PERFUMING COMPOSITION FIRMENICH SA (CH) 2022-06-23 WO disclosed
EP-1341502-A2 HAIR CONDITIONING COMPOSITIONS AND THEIR USE IN HAIR COLOURING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2003-09-10 EP disclosed
WO-2002047632-A2 HAIR CONDITIONING COMPOSITIONS COMPRISING AMINOFUNCTIONA POLYSILOXANES THE PROCTER & GAMBLE COMPANY (US) 2002-06-20 WO disclosed