SCHEMBL8208634

SCHEMBL8208634

O=C1CCCN1C(=O)OCCO.[NaH]

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.50
TDP1 Q9NUW8 2/20 0.39
POLB P06746 1/20 0.39
KMT2A Q03164 3/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39
MAPT P10636 1/20 0.39
THRB P10828 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
RECQL P46063 1/20 0.39
BLM P54132 1/20 0.39
CASP6 P55212 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
TSHR P16473 1/20 0.36
RAB9A P51151 1/20 0.35
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33

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
SCHEMBL6219776 0.83 LMNA (0.50) LMNATDP1POLBKMT2AKDM4E
SCHEMBL1231766 0.80 LMNA (0.55) LMNATDP1POLBKMT2AKDM4E
SCHEMBL10530778 0.80 LMNA (0.47) LMNATDP1POLBKMT2AKDM4E
SCHEMBL4049351 0.80 LMNA (0.47) LMNATDP1POLBKMT2AKDM4E
SCHEMBL11686037 0.79 LMNA (0.46) LMNATDP1POLBKMT2AKDM4E
SCHEMBL11681393 0.79 LMNA (0.46) LMNATDP1POLBKMT2AKDM4E
SCHEMBL10530789 0.79 LMNA (0.53) LMNATDP1POLBKMT2AKDM4E
SCHEMBL20553757 0.78 LMNA (0.44) LMNATDP1POLBKMT2AKDM4E
SCHEMBL10494901 0.78 LMNA (0.45) LMNAPOLBTSHR
SCHEMBL10494979 0.78 LMNA (0.45) LMNAPOLBTSHR

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6024941-A VITAMIN A AND STABILIZERS SHISEIDO COMPANY, LTD. (JP) 2000-02-15 US disclosed
US-5484816-A STABILIZED VITAMIN A COMPOSITION SHISEIDO COMPANY, LTD. (JP) 1996-01-16 US disclosed