SCHEMBL22236038

SCHEMBL22236038

CCCCC1NC(C)(C(=O)O)CO1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31

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
SCHEMBL7201103 0.69 ALDH1A1 (0.44) ALDH1A1CYP1A2
SCHEMBL27932564 0.68 MAPK1 (0.41) USP2ALDH1A1GAA
SCHEMBL27932565 0.67 MAPK1 (0.40) USP2ALDH1A1GAA
SCHEMBL22233215 0.66 CYP2C19 (0.31) CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL6192081 0.66 ALDH1A1 (0.40) ALDH1A1
SCHEMBL6194532 0.66 ALDH1A1 (0.40) ALDH1A1
SCHEMBL6194421 0.66 ALDH1A1 (0.40) ALDH1A1
SCHEMBL6198171 0.66 ALDH1A1 (0.40) ALDH1A1
SCHEMBL6195417 0.66 ALDH1A1 (0.40) ALDH1A1
SCHEMBL6193299 0.66 ALDH1A1 (0.40) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3911643-A1 ANTIMICROBIAL COMPOUNDS AND METHODS Curza Global LLC (US) 2021-11-24 EP disclosed
WO-2020150372-A1 ANTIMICROBIAL COMPOUNDS AND METHODS CURZA GLOBAL, LLC (US) 2020-07-23 WO disclosed