SCHEMBL9818656

SCHEMBL9818656

O=C(NCC1(c2ccccc2)CCCCC1)Nc1ccc(Cl)c(Cl)c1

nearest known ligand 0.65

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.65
CNR1 P21554 1/20 0.65
KMT2A Q03164 4/20 0.63
USP2 O75604 1/20 0.63
LMNA P02545 3/20 0.53
L3MBTL1 Q9Y468 2/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
GLA P06280 1/20 0.52
HTT P42858 1/20 0.52
MEN1 O00255 3/20 0.51
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
KCNH2 Q12809 1/20 0.50
CACNA1I Q9P0X4 1/20 0.50
EPHX1 P07099 1/20 0.50
EPHX2 P34913 1/20 0.50
TRPV1 Q8NER1 1/20 0.49
HSD17B10 Q99714 1/20 0.49

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
SCHEMBL9818669 0.86 CNR1 (0.87) MAPTCNR1KMT2ALMNAL3MBTL1
SCHEMBL9818668 0.84 CNR1 (0.70) CNR1KMT2ALMNAL3MBTL1SMN1; SMN2
SCHEMBL300331 0.83 CNR1 (0.72) CNR1KMT2ALMNAL3MBTL1SMN1; SMN2
SCHEMBL9818664 0.82 CNR1 (0.60) MAPTCNR1KMT2ALMNAL3MBTL1
SCHEMBL9818621 0.81 CNR1 (0.66) MAPTCNR1KMT2ALMNAL3MBTL1
SCHEMBL8007084 0.81 CNR1 (0.59) MAPTCNR1KMT2ALMNAL3MBTL1
SCHEMBL9818691 0.81 CNR1 (0.66) MAPTCNR1KMT2ALMNAL3MBTL1
SCHEMBL9818576 0.81 LMNA (0.68) CNR1KMT2ALMNAL3MBTL1SMN1; SMN2
SCHEMBL9818643 0.81 MAPT (0.56) MAPTCNR1KMT2ALMNAL3MBTL1
SCHEMBL9818715 0.81 CNR1 (0.65) MAPTCNR1KMT2ALMNAL3MBTL1

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-5015644-A Antihyperlipidemic and antiatherosclerotic urea and carbamate compounds WARNER-LAMBERT COMPANY (US) 1991-05-14 US disclosed