SCHEMBL2484748

SCHEMBL2484748

O=C(O)N1CCCC1C1CCCNC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A1 P30531 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
SLC6A11 P48066 1/20 0.42
TSHR P16473 1/20 0.42
LMNA P02545 1/20 0.42
SLC6A13 Q9NSD5 1/20 0.42
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
HTR2C P28335 1/20 0.37
KMT2A Q03164 2/20 0.37
KDM4E B2RXH2 1/20 0.37
MAPT P10636 1/20 0.37
ATM Q13315 1/20 0.37
CYP2D6 P10635 1/20 0.37
DPP4 P27487 4/20 0.36
DPP8 Q6V1X1 3/20 0.36
FAP Q12884 2/20 0.36
DPP9 Q86TI2 2/20 0.36
DPP7 Q9UHL4 1/20 0.36
CPN1 P15169 2/20 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
SCHEMBL652905 0.84 NPC1 (0.36) SMN1; SMN2NPC1RAB9AHTR2CDPP4
SCHEMBL652903 0.84 NPC1 (0.36) SMN1; SMN2NPC1RAB9AHTR2CDPP4
SCHEMBL652904 0.84 NPC1 (0.36) SMN1; SMN2NPC1RAB9AHTR2CDPP4
SCHEMBL29264141 0.84 NPC1 (0.36) SMN1; SMN2NPC1RAB9AHTR2CDPP4
SCHEMBL19974288 0.81 NPC1 (0.43) SMN1; SMN2TSHRNPC1RAB9ADPP4
SCHEMBL15533257 0.81 NPC1 (0.43) SMN1; SMN2TSHRNPC1RAB9ADPP4
SCHEMBL20744258 0.81 SLC6A1 (0.36) SLC6A1SMN1; SMN2SLC6A11TSHRLMNA
SCHEMBL334462 0.81 SLC6A1 (0.36) SLC6A1SMN1; SMN2SLC6A11TSHRLMNA
SCHEMBL18692612 0.81 SLC6A1 (0.36) SLC6A1SMN1; SMN2SLC6A11TSHRLMNA
SCHEMBL3169796 0.80 NPC1 (0.51) SMN1; SMN2NPC1RAB9ADPP7POLB

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-2011117254-A1 PIPERIDINE AMIDES AS MODULATORS OF THE GHRELIN RECEPTOR PROSIDION LIMITED (GB) 2011-09-29 WO disclosed