SCHEMBL27463593

SCHEMBL27463593

OC(Cc1ccccc1)C1CCCNC1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CPN1 P15169 1/20 0.42
CPB2 Q96IY4 1/20 0.42
KDM1A O60341 1/20 0.41
MAOB P27338 1/20 0.41
KMT2A Q03164 1/20 0.40
SLC6A2 P23975 1/20 0.38
SLC6A4 P31645 1/20 0.38
SLC6A3 Q01959 1/20 0.38

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
SCHEMBL5191726 0.95 POLB (0.41) CPN1CPB2KDM1AMAOBSLC6A2
SCHEMBL7457154 0.90 SLC6A2 (0.43) SLC6A2SLC6A4SLC6A3
SCHEMBL8328007 0.85 HTR3A (0.41) SLC6A2SLC6A4SLC6A3
SCHEMBL10341465 0.83 SLC6A2 (0.47) SLC6A2SLC6A4SLC6A3
SCHEMBL10435882 0.81 FLT3 (0.39) CPN1CPB2
SCHEMBL25971517 0.81 EPHX2 (0.43)
SCHEMBL9281404 0.81 CHRM2 (0.39) CPN1CPB2KDM1AMAOBKMT2A
SCHEMBL28282168 0.81 CPN1 (0.42) CPN1CPB2KDM1AMAOBKMT2A
SCHEMBL7304914 0.80 GBA1 (0.50) KMT2ASLC6A2SLC6A4SLC6A3
SCHEMBL25518645 0.80 EPHX2 (0.46)

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
CN-1137095-C The preparation of i(N)-substituted-hydroxycycloalkylamine derivatives 三星精密化学株式会社 2004-02-04 CN disclosed
CN-1323293-A The preparation of i(N)-substituted-hydroxycycloalkylamine derivatives SAMSUNG FINE CHEMICALS CO LTD (KR) 2001-11-21 CN disclosed