SCHEMBL23736402

SCHEMBL23736402

Cc1ccc(CC(=O)N2C(=O)OCC2CCc2ccccc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 5/20 0.54
TDP1 Q9NUW8 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
LMNA P02545 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
FAAH O00519 2/20 0.43
ALDH1A1 P00352 3/20 0.41
HPGD P15428 1/20 0.41
CYP2C19 P33261 1/20 0.41
IL6ST P40189 1/20 0.41
GPR183 P32249 1/20 0.40
GAA P10253 1/20 0.40
PKM P14618 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 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
SCHEMBL23522276 0.88 NAAA (0.51) NAAATDP1L3MBTL1LMNASMN1; SMN2
SCHEMBL23866771 0.88 NAAA (0.51) NAAATDP1L3MBTL1LMNASMN1; SMN2
SCHEMBL23902846 0.88 NAAA (0.51) NAAATDP1L3MBTL1LMNASMN1; SMN2
SCHEMBL23736405 0.85 NAAA (0.42) NAAASMN1; SMN2FAAHMEN1KMT2A
SCHEMBL16594226 0.81 NAAA (0.60) NAAATDP1L3MBTL1FAAH
SCHEMBL16594224 0.81 NAAA (0.60) NAAATDP1L3MBTL1FAAH
SCHEMBL19192764 0.81 NAAA (0.50) NAAAFAAHIL6ST
SCHEMBL1915643 0.80 NAAA (0.47) NAAAL3MBTL1FAAHALDH1A1HPGD
SCHEMBL1915646 0.80 NAAA (0.47) NAAAL3MBTL1FAAHALDH1A1HPGD
SCHEMBL7346791 0.80 NAAA (0.47) NAAAL3MBTL1FAAHALDH1A1HPGD

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-3376870-B1 PROCESS FOR THE PREPARATION OF KINASE INHIBITORS AND INTERMEDIATES THEREOF AERIE PHARMACEUTICALS INC (US) 2021-08-11 EP disclosed