SCHEMBL6232059

SCHEMBL6232059

COC1(C2CCCCC2)CCC(N2CCN(c3ccc(-c4ccc(C(=O)O)cc4)cc3)CC2)CC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
CHEK1 O14757 2/20 0.42
KDM4E B2RXH2 4/20 0.41
TDP1 Q9NUW8 1/20 0.41
ALDH1A1 P00352 2/20 0.41
HRH3 Q9Y5N1 3/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
ESR1 P03372 2/20 0.40
ESR2 Q92731 1/20 0.40
MBTD1 Q05BQ5 1/20 0.40
TP53BP1 Q12888 1/20 0.40
L3MBTL4 Q8NA19 1/20 0.40
L3MBTL3 Q96JM7 1/20 0.40
PDE4A P27815 1/20 0.39
PDE4B Q07343 1/20 0.39
PDE4C Q08493 1/20 0.39
PDE4D Q08499 1/20 0.39
ITGB3 P05106 1/20 0.39

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
SCHEMBL6132187 1.00 USP2 (0.43) USP2MEN1KMT2ACHEK1KDM4E
SCHEMBL6132188 1.00 USP2 (0.43) USP2MEN1KMT2ACHEK1KDM4E
SCHEMBL6132744 0.97 USP2 (0.46) USP2MEN1KMT2AKDM4ETDP1
SCHEMBL6132596 0.91 ALDH1A1 (0.43) MEN1KMT2AKDM4ETDP1ALDH1A1
SCHEMBL6132374 0.91 ALDH1A1 (0.43) MEN1KMT2AKDM4ETDP1ALDH1A1
SCHEMBL6132375 0.91 ALDH1A1 (0.43) MEN1KMT2AKDM4ETDP1ALDH1A1
SCHEMBL6133752 0.87 MEN1 (0.39) MEN1KMT2AKDM4ETDP1ALDH1A1
SCHEMBL6133750 0.87 MEN1 (0.39) MEN1KMT2AKDM4ETDP1ALDH1A1
SCHEMBL13099171 0.85 USP2 (0.52) USP2MEN1KMT2ACHEK1KDM4E
SCHEMBL6133874 0.84 ALDH1A1 (0.43) MEN1KMT2AKDM4EALDH1A1HRH3

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
EP-1259535-B1 CYCLIC HEXAPEPTIDE DERIVATIVES FUJISAWA PHARMACEUTICAL CO (JP) 2005-04-13 EP disclosed