SCHEMBL18616977

SCHEMBL18616977

CCOC(=O)C1CC(NCc2ccccc2)C1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PKM P14618 2/20 0.49
NPSR1 Q6W5P4 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.48
PPID Q08752 1/20 0.47
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
ALDH1A1 P00352 3/20 0.45
HSD17B10 Q99714 1/20 0.45
KDM4E B2RXH2 1/20 0.45
LMNA P02545 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
POLB P06746 1/20 0.44
CCR8 P51685 1/20 0.44
MAPT P10636 1/20 0.44

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
SCHEMBL25635448 0.81 ALDH1A1 (0.47) PKMNPSR1MEN1KMT2AALDH1A1
SCHEMBL1848799 0.80 FUCA1 (0.47) PKMNPSR1SMN1; SMN2PPIDMEN1
SCHEMBL23948570 0.80 CYP1A2 (0.48) MEN1KMT2AALDH1A1HSD17B10POLB
SCHEMBL15229052 0.79 TACR1 (0.41) PKMNPSR1SMN1; SMN2PPIDMEN1
SCHEMBL28452828 0.79 TACR1 (0.41) PKMNPSR1SMN1; SMN2PPIDMEN1
SCHEMBL3541508 0.79 L3MBTL1 (0.53) PKMNPSR1MEN1KMT2AALDH1A1
SCHEMBL29143659 0.78 DPP8 (0.49) PKMSMN1; SMN2MEN1KMT2AMAPT
SCHEMBL31294333 0.78 DPP8 (0.49) PKMSMN1; SMN2MEN1KMT2AMAPT
SCHEMBL30733542 0.78 DPP8 (0.49) PKMSMN1; SMN2MEN1KMT2AMAPT
SCHEMBL30733538 0.78 DPP8 (0.49) PKMSMN1; SMN2MEN1KMT2AMAPT

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
WO-2017040606-A1 ISOXAZOLE DERIVATIVES FOR USE IN THE TREATMENT OF PULMONARY DISEASES AND DISORDERS PROTEOSTASIS THERAPEUTICS, INC. (US) 2017-03-09 WO disclosed