SCHEMBL23544487

SCHEMBL23544487

CC(CNC(=O)OC(C)(C)C)Cc1cc(Cl)ccc1O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ANO1 Q5XXA6 5/20 0.44
IDO1 P14902 3/20 0.44
PCSK9 Q8NBP7 1/20 0.43
SERPINE1 P05121 1/20 0.41
PTGER1 P34995 1/20 0.40
CTSL P07711 1/20 0.40
GAA P10253 1/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
HPGD P15428 3/20 0.39
HTT P42858 3/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
ALDH1A1 P00352 2/20 0.39
TP53 P04637 2/20 0.39
KDM4E B2RXH2 1/20 0.39
MAPT P10636 2/20 0.39
SLC22A1 O15245 1/20 0.39
USP2 O75604 1/20 0.39
LMNA P02545 1/20 0.39
HSP90AA1 P07900 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
SCHEMBL3734185 0.82 ANO1 (0.51) ANO1IDO1GAASMN1; SMN2HPGD
SCHEMBL23086057 0.79 ALOX15 (0.46) PCSK9SERPINE1SMN1; SMN2HPGDMEN1
SCHEMBL27207487 0.78 PPARA (0.51) CTSLGAAHPGDALDH1A1KDM4E
SCHEMBL27203760 0.78 PPARA (0.51) CTSLGAAHPGDALDH1A1KDM4E
SCHEMBL30825606 0.77 KLK5 (0.47) IDO1CTSLGAASMN1; SMN2HPGD
SCHEMBL248758 0.74 GAA (0.48) ANO1IDO1GAASMN1; SMN2HPGD
SCHEMBL18052209 0.74 PCSK9 (0.48) PCSK9CTSLHPGDHTTMEN1
SCHEMBL14047146 0.74 PCSK9 (0.48) PCSK9CTSL
SCHEMBL30079765 0.74 IDO1 (0.52) ANO1IDO1GAASMN1; SMN2HPGD
SCHEMBL20446470 0.74 IDO1 (0.52) ANO1IDO1GAASMN1; SMN2HPGD

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-3250549-B1 CYCLOPROPYLMETHANAMINES AS SELECTIVE 5-HT(2C) RECEPTOR AGONISTS UNIV ILLINOIS (US) 2021-06-23 EP disclosed