SCHEMBL20604121

SCHEMBL20604121

CCCC[C@H](CC)COCC(O)COc1ccc(-c2nc(-c3ccc(C)cc3C)nc(-c3ccc(C)cc3C)n2)c(O)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G4B P0C869 1/20 0.33
LMNA P02545 5/20 0.33
ALDH1A1 P00352 5/20 0.32
TSHR P16473 3/20 0.32
MAPK1 P28482 2/20 0.32
ADRB2 P07550 2/20 0.32
ADRB1 P08588 1/20 0.32
SMN1; SMN2 Q16637 5/20 0.31
TP53 P04637 4/20 0.31
NPC1 O15118 2/20 0.31
RAB9A P51151 2/20 0.31
POLB P06746 1/20 0.31
NFKB1 P19838 1/20 0.31
NFKB2 Q00653 1/20 0.31
RELA Q04206 1/20 0.31
MAPT P10636 2/20 0.31
TDP1 Q9NUW8 2/20 0.31
HTT P42858 1/20 0.31
ATM Q13315 1/20 0.31
KMT2A Q03164 2/20 0.31

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
SCHEMBL77080 1.00 PLA2G4B (0.33) PLA2G4BLMNAALDH1A1TSHRMAPK1
SCHEMBL28354317 0.95 CDK4 (0.32) PLA2G4BLMNAALDH1A1TSHRMAPK1
SCHEMBL22017460 0.95 PLA2G4B (0.35) PLA2G4BLMNAALDH1A1TSHRMAPK1
SCHEMBL6051228 0.94 TP53 (0.32) PLA2G4BLMNAALDH1A1TSHRMAPK1
SCHEMBL14431829 0.92 ADRB2 (0.36) LMNAALDH1A1TSHRADRB2ADRB1
SCHEMBL12755375 0.92 PLA2G4B (0.38) PLA2G4BLMNAALDH1A1TSHRMAPK1
SCHEMBL8910146 0.92 PLA2G4B (0.33) PLA2G4BLMNAALDH1A1TSHRMAPK1
SCHEMBL16083397 0.92 PLA2G4B (0.33) PLA2G4BLMNAALDH1A1TSHRMAPK1
SCHEMBL20024340 0.91 LMNA (0.37) LMNAALDH1A1TSHRMAPK1SMN1; SMN2
SCHEMBL7894750 0.91 LMNA (0.37) LMNAALDH1A1TSHRMAPK1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023227472-A1 POLYCARBONATE COMPOSITION CONTAINING COMBINATION OF HYDROXYPHENYL TRIAZINES AND UV ABSORBERS BASF SE (DE) 2023-11-30 WO disclosed
EP-3924429-A1 IR ABSORBING NAPHTHALOCYANINE AND PHTHALOCYANINE CHROMOPHORES BASF SE (DE) 2021-12-22 EP disclosed
WO-2020165099-A1 IR ABSORBING NAPHTHALOCYANINE AND PHTHALOCYANINE CHROMOPHORES BASF SE (DE) 2020-08-20 WO disclosed
EP-3424977-A1 HINDERED POLYMERIC AMINES 3V SIGMA S.p.A (IT) 2019-01-09 EP disclosed