SCHEMBL8601443

SCHEMBL8601443

CN(C)c1cccc(NC(=O)N(C2CCCCCC2)C2(C)CCCCC2)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.48
POLB P06746 2/20 0.48
ATM Q13315 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.44
KDM4E B2RXH2 2/20 0.44
NPC1 O15118 1/20 0.44
GFER P55789 1/20 0.44
HSD17B10 Q99714 1/20 0.44
MAPT P10636 1/20 0.41
UBE2M P61081 1/20 0.41
DCUN1D1 Q96GG9 1/20 0.41
ALDH1A1 P00352 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
GAA P10253 1/20 0.40
ALOX15 P16050 1/20 0.40
HDAC6 Q9UBN7 2/20 0.40
HTT P42858 1/20 0.40
PNPLA2 Q96AD5 1/20 0.40
MAPK1 P28482 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
SCHEMBL8601811 0.86 EPHX1 (0.52) RAB9APOLBATMSMN1; SMN2KDM4E
SCHEMBL8605647 0.86 EPHX1 (0.52) RAB9APOLBATMSMN1; SMN2KDM4E
SCHEMBL8603355 0.86 EPHX1 (0.52) RAB9APOLBATMSMN1; SMN2KDM4E
SCHEMBL8636134 0.86 EPHX1 (0.52) RAB9APOLBATMSMN1; SMN2KDM4E
SCHEMBL8603990 0.79 EPHX1 (0.47) RAB9AATMSMN1; SMN2KDM4ENPC1
SCHEMBL8603993 0.78 ATM (0.47) RAB9APOLBATMSMN1; SMN2KDM4E
SCHEMBL8601330 0.78 NPC1 (0.50) RAB9APOLBSMN1; SMN2NPC1HSD17B10
SCHEMBL8604073 0.77 ATM (0.44) RAB9APOLBATMSMN1; SMN2NPC1
SCHEMBL8605923 0.77 RAB9A (0.47) RAB9APOLBATMSMN1; SMN2NPC1
SCHEMBL8604411 0.77 RAB9A (0.54) RAB9APOLBATMNPC1GFER

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-5733931-A ANTICHOLESTEROL AGENTS NISSIN FOOD PRODUCTS CO., LTD. (JP) 1998-03-31 US disclosed