SCHEMBL22636619

SCHEMBL22636619

CC1(C)OB(c2ccc(-c3cccnc3)c([N+](=O)[O-])c2)OC1(C)C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 5/20 0.42
CYP11B2 P19099 5/20 0.42
CYP19A1 P11511 3/20 0.42
MAPK1 P28482 1/20 0.42
LIPG Q9Y5X9 2/20 0.40
LPL P06858 1/20 0.40
CHRNB2 P17787 2/20 0.40
CHRNA5 P30532 2/20 0.40
CHRNA4 P43681 2/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
CYP2A6 P11509 1/20 0.39
RAB9A P51151 1/20 0.37
TP53 P04637 1/20 0.37
ABCB1 P08183 1/20 0.37
ABCC1 P33527 1/20 0.37
KDM4E B2RXH2 1/20 0.36
MAPT P10636 1/20 0.36
HTT P42858 1/20 0.36
GFER P55789 1/20 0.36

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
SCHEMBL29430793 1.00 CYP11B1 (0.42) CYP11B1CYP11B2CYP19A1MAPK1LIPG
SCHEMBL22647885 0.86 LIPG (0.53) LIPGLPLRAB9AMAPTTDP1
SCHEMBL29430803 0.81 LIPG (0.43) LIPGLPLMAPTTDP1
SCHEMBL22637643 0.81 LIPG (0.43) LIPGLPLMAPTTDP1
SCHEMBL10338913 0.81 CYP19A1 (0.58) CYP11B1CYP11B2CYP19A1MAPK1CHRNB2
SCHEMBL22636737 0.79 LIPG (0.45) CYP11B1CYP11B2CYP19A1LIPGLPL
SCHEMBL29430844 0.79 LIPG (0.45) CYP11B1CYP11B2CYP19A1LIPGLPL
SCHEMBL22637535 0.79 MAPT (0.39) LIPGLPLMEN1KMT2ARAB9A
SCHEMBL4468465 0.77 MEN1 (0.49) CYP11B1CYP11B2CYP19A1MAPK1MEN1
SCHEMBL31401337 0.76 LIPG (0.45) CYP11B1CYP11B2LIPGLPLCHRNB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12023333-B2 Phenyl-sulfamoyl.benzoyc acids as ERAP1 modulators Grey Wolf Therapeutics Limited (GB) 2024-07-02 US disclosed
US-12023333-B2 Phenyl-sulfamoyl.benzoyc acids as ERAP1 modulators Grey Wolf Therapeutics Limited (GB) 2024-07-02 US disclosed
US-20220347176-A1 PHENYL-SULFAMOYL.BENZOYC ACIDS AS ERAP1 MODULATORS Grey Wolf Therapeutics Limited (GB) 2022-11-03 US disclosed
EP-3966196-A1 PHENYL-SULFAMOYL.BENZOYC ACIDS AS ERAP1 MODULATORS Grey Wolf Therapeutics Limited (GB) 2022-03-16 EP disclosed
WO-2020225569-A1 PHENYL-SULFAMOYL.BENZOYC ACIDS AS ERAP1 MODULATORS Grey Wolf Therapeutics Limited (GB) 2020-11-12 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20220347176-A1 PHENYL-SULFAMOYL.BENZOYC ACIDS AS ERAP1 MODULATORS ERAP1, CHP1, QSOX1 CYP11B1 2298/4885CYP11B2 3239/4885CYP19A1 1876/4885
US-12023333-B2 Phenyl-sulfamoyl.benzoyc acids as ERAP1 modulators ERAP1, CHP1, QSOX1 CYP11B1 1751/4885CYP11B2 2780/4885CYP19A1 1631/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.