SCHEMBL19254215

SCHEMBL19254215

CCCN(C[C@H](O)Cc1ccccc1Cl)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP51A1 Q16850 1/20 0.44
TP53 P04637 1/20 0.40
PPARG P37231 1/20 0.39
PPARA Q07869 1/20 0.39
ALDH1A1 P00352 1/20 0.39
CTBP2 P56545 1/20 0.38
HTT P42858 1/20 0.38
EGFR P00533 1/20 0.38
ABCB1 P08183 2/20 0.36
TAAR1 Q96RJ0 1/20 0.36
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
SLC6A3 Q01959 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
SCHEMBL15066241 1.00 CYP51A1 (0.44) CYP51A1TP53PPARGPPARAALDH1A1
SCHEMBL19254236 0.83 TAS2R14 (0.42) PPARGPPARAALDH1A1EGFR
SCHEMBL15066203 0.83 TAS2R14 (0.42) PPARGPPARAALDH1A1EGFR
SCHEMBL23347530 0.80 PPARG (0.43) PPARGPPARAALDH1A1CTBP2TAAR1
SCHEMBL15066984 0.80 PPARG (0.43) PPARGPPARAALDH1A1CTBP2TAAR1
SCHEMBL18568293 0.79 TAAR1 (0.53) CYP51A1TP53CTBP2HTTEGFR
SCHEMBL15066448 0.78 MEN1 (0.41) PPARGPPARAALDH1A1CTBP2SLC6A2
SCHEMBL15066559 0.73 SLC6A2 (0.46) PPARGPPARASLC6A2SLC6A4SLC6A3
SCHEMBL14402476 0.73 SLC6A2 (0.44) CYP51A1PPARGPPARAALDH1A1CTBP2
SCHEMBL13849913 0.73 SLC6A2 (0.44) CYP51A1PPARGPPARAALDH1A1CTBP2

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-2968211-B1 PHENYL ALKYL CARBAMATE COMPOUNDS FOR USE IN PREVENTING OR TREATING EPILEPSY OR EPILEPSY-RELATED SYNDROME BIO PHARM SOLUTIONS CO LTD (KR) 2021-05-12 EP disclosed
EP-2797878-B1 PHENYL CARBAMATE COMPOUNDS FOR USE IN PREVENTING OR TREATING STROKE BIO-PHARM SOLUTIONS CO LTD (KR) 2017-08-16 EP disclosed