SCHEMBL9469262

SCHEMBL9469262

CC1CN(C(=O)N(C)C2CCCCC2)CCO1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDK1 Q15118 1/20 0.43
LIPE Q05469 1/20 0.42
GLRA1 P23415 1/20 0.42
USP30 Q70CQ3 1/20 0.41
ALDH1A1 P00352 3/20 0.38
PKM P14618 1/20 0.38
SIGMAR1 Q99720 1/20 0.37
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
ABHD6 Q9BV23 2/20 0.34
LMNA P02545 1/20 0.34
HTT P42858 1/20 0.34
POLB P06746 1/20 0.34
MCHR1 Q99705 2/20 0.34
VNN1 O95497 1/20 0.34

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
SCHEMBL4375383 0.80 MAPT (0.50) LIPEALDH1A1PKMNPC1RAB9A
SCHEMBL12233567 0.79 PDK1 (0.51) PDK1GLRA1USP30ALDH1A1NPC1
SCHEMBL15551380 0.76 LIPE (0.44) LIPEALDH1A1PKMHTT
SCHEMBL28019652 0.76 LIPE (0.44) LIPEALDH1A1PKMHTT
SCHEMBL24518383 0.76 LIPE (0.44) LIPEALDH1A1PKMHTT
SCHEMBL24511489 0.75 DPP4 (0.41) LIPEUSP30ALDH1A1PKMSIGMAR1
SCHEMBL24511675 0.75 DPP4 (0.41) LIPEUSP30ALDH1A1PKMSIGMAR1
SCHEMBL24517987 0.75 DPP4 (0.41) LIPEUSP30ALDH1A1PKMSIGMAR1
SCHEMBL26817707 0.74 PDK1 (0.50) PDK1GLRA1USP30RAB9ALMNA
SCHEMBL12233849 0.73 PDK1 (0.49) PDK1GLRA1ALDH1A1LMNA

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
US-5218002-A Morpholinoureas BAYER AKTIENGESELLSCHAFT (DE) 1993-06-08 US claimed