SCHEMBL30987481

SCHEMBL30987481

OC(CON1CCC(c2ccccn2)CC1)CN1CCCCC1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.50
TSHR P16473 2/20 0.50
PRMT5 O14744 2/20 0.50
WDR77 Q9BQA1 2/20 0.50
HIF1A Q16665 1/20 0.50
KDM4E B2RXH2 2/20 0.48
ATM Q13315 1/20 0.47
ACE2 Q9BYF1 1/20 0.46
CYP2C19 P33261 1/20 0.46
RAB9A P51151 1/20 0.45
HSD17B10 Q99714 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.44
ABCB1 P08183 6/20 0.43
POLB P06746 1/20 0.43
ADORA2A P29274 1/20 0.42

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
SCHEMBL30987490 0.79 CYP11B2 (0.47) CYP2D6TSHRPRMT5WDR77HIF1A
SCHEMBL6198664 0.77 DRD4 (0.47) PRMT5WDR77HSD17B10SMN1; SMN2POLB
SCHEMBL30987478 0.75 TSHR (0.42) CYP2D6TSHRHIF1AKDM4EATM
SCHEMBL6197454 0.74 DRD4 (0.49) PRMT5WDR77
SCHEMBL30987501 0.73 ADRB2 (0.54) CYP2D6TSHRPRMT5WDR77HIF1A
SCHEMBL30987486 0.72 KMT2A (0.52) CYP2D6TSHRHIF1AKDM4EATM
SCHEMBL30987489 0.72 KMT2A (0.52) CYP2D6TSHRHIF1AKDM4EATM
SCHEMBL30987497 0.72 KMT2A (0.52) CYP2D6TSHRHIF1AKDM4EATM
SCHEMBL31127629 0.70 DRD4 (0.52) KDM4E
SCHEMBL30987499 0.70 KMT2A (0.46) CYP2D6TSHRHIF1AKDM4EATM

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
CN-118139842-A Oximes and their use in the treatment of GBA related diseases 泽拉丹麦有限公司 2024-06-04 CN disclosed