SCHEMBL11019253

SCHEMBL11019253

COc1ccc2cc([C@]3(C(=O)O)CCCN3)ccc2c1Cl

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
SLC6A4 P31645 4/20 0.38
SLC6A2 P23975 3/20 0.38
CYP19A1 P11511 1/20 0.37
CYP11B1 P15538 1/20 0.37
CYP11B2 P19099 1/20 0.37
SLC6A3 Q01959 2/20 0.36
NCEH1 Q6PIU2 3/20 0.36
SELP P16109 3/20 0.34
SELL P14151 2/20 0.34
CHRNA7 P36544 1/20 0.33
HTR3A P46098 1/20 0.33

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
SCHEMBL8026178 0.81 KDM4E (0.43) LMNA
SCHEMBL8469123 0.81 KDM4E (0.43) LMNA
SCHEMBL15664683 0.76 TET3 (0.42) KMT2AL3MBTL1SLC6A4SLC6A3
SCHEMBL15664899 0.73 DRD2 (0.43) MEN1KMT2A
SCHEMBL10483428 0.70 ESR2 (0.41) SLC6A4SLC6A2SLC6A3
SCHEMBL10659448 0.70 AKR1C1 (0.48) LMNAMEN1KMT2A
SCHEMBL435512 0.70 AKR1C1 (0.48) LMNAMEN1KMT2A
SCHEMBL994596 0.70 AKR1C1 (0.48) LMNAMEN1KMT2A
SCHEMBL38656246 0.69 CA12 (0.57) LMNAMEN1KMT2ACYP19A1CYP11B1
SCHEMBL5693936 0.69 CA12 (0.57) LMNAMEN1KMT2ACYP19A1CYP11B1

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-0163338-A1 Process for preparing naproxen Nobel Chemicals AB (SE) 1985-12-04 EP disclosed