SCHEMBL7668667

SCHEMBL7668667

O=C1CN(C(=O)OCc2ccccc2)CCN1CCC12CC3CC(CC(C3)C1)C2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP19 O94966 1/20 0.46
SMN1; SMN2 Q16637 4/20 0.45
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
PKM P14618 1/20 0.44
CYP2C19 P33261 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
HSD11B1 P28845 2/20 0.41
TMEM97 Q5BJF2 6/20 0.40
SIGMAR1 Q99720 6/20 0.40
EPHX2 P34913 3/20 0.40
HTR1A P08908 1/20 0.40
ADRA2A P08913 1/20 0.40
ADRA2B P18089 1/20 0.40
ADRA2C P18825 1/20 0.40
DRD1 P21728 1/20 0.40
HRH2 P25021 1/20 0.40
HTR1B P28222 1/20 0.40

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
SCHEMBL7526701 0.89 USP19 (0.49) USP19SMN1; SMN2NPC1RAB9AMEN1
SCHEMBL3622805 0.81 MEN1 (0.51) USP19SMN1; SMN2NPC1RAB9AMEN1
SCHEMBL7668679 0.80 USP19 (0.46) USP19SMN1; SMN2NPC1RAB9AMEN1
SCHEMBL16475199 0.80 TMEM97 (0.52) USP19SMN1; SMN2NPC1RAB9AMEN1
SCHEMBL4391159 0.80 MEN1 (0.50) USP19SMN1; SMN2NPC1RAB9AMEN1
SCHEMBL28429220 0.79 USP19 (0.49) USP19SMN1; SMN2NPC1RAB9AMEN1
SCHEMBL3902852 0.78 SMN1; SMN2 (0.56) USP19SMN1; SMN2NPC1RAB9AMEN1
SCHEMBL28429226 0.78 MEN1 (0.48) USP19SMN1; SMN2NPC1RAB9AMEN1
SCHEMBL28433633 0.78 P2RX7 (0.49) USP19SMN1; SMN2NPC1RAB9AMEN1
SCHEMBL8386105 0.77 KMT2A (0.52) USP19SMN1; SMN2NPC1RAB9AMEN1

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-6335343-B1 IMIDAZOL-5-YLALKYLPIPERIZINE DERIVATIVES; ANTICARCINOGENIC AGENTS MERCK & CO., INC. 2002-01-01 US disclosed