SCHEMBL7972106

SCHEMBL7972106

CC(C)(C)OC(=O)N1CCCCC1CNC(=O)C1=Cc2cnc3cccc(n23)S1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
METTL3 Q86U44 1/20 0.42
KDM1A O60341 1/20 0.41
OPRD1 P41143 1/20 0.41
PRMT5 O14744 1/20 0.39
FPR3 P25089 1/20 0.38
FPR2 P25090 1/20 0.38
AHCY P23526 3/20 0.38
IL1B P01584 2/20 0.38
NAMPT P43490 1/20 0.37
ACKR3 P25106 1/20 0.37
KDM4E B2RXH2 1/20 0.36
PKM P14618 1/20 0.36
ALOX5AP P20292 1/20 0.36
FEN1 P39748 1/20 0.36
ATM Q13315 2/20 0.35
P2RX7 Q99572 1/20 0.35
TRPV1 Q8NER1 1/20 0.35
HCRTR1 O43613 2/20 0.35
HCRTR2 O43614 2/20 0.35
USP30 Q70CQ3 1/20 0.35

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
SCHEMBL7981738 0.84 KDM4E (0.55) NAMPTACKR3KDM4EPKM
SCHEMBL7987532 0.84 USP30 (0.39) KDM4EUSP30
SCHEMBL7987167 0.80 KDM4E (0.45) NAMPTKDM4EPKMUSP30
Hydrochloric Acid SCHEMBL7981565 0.76 HTR1A (0.43) OPRD1
SCHEMBL7989896 0.75 ACKR3 (0.49) ACKR3
SCHEMBL8504314 0.74 KDM1A (0.40) METTL3KDM1AOPRD1PRMT5FPR3
Hydrochloric Acid SCHEMBL7986017 0.74 IKBKB (0.45)
SCHEMBL28153227 0.74 KDM1A (0.50) METTL3KDM1AOPRD1PRMT5FPR3
SCHEMBL6223221 0.73 KDM4E (0.64) METTL3KDM1AOPRD1PRMT5FPR3
SCHEMBL6223223 0.73 KDM4E (0.64) METTL3KDM1AOPRD1PRMT5FPR3

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-6235731-B1 REDUCING BLOOD LIPIDS, SUGARS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-05-22 US disclosed