SCHEMBL26121908

SCHEMBL26121908

COc1cc(OC)c(C(=O)F)c(OC)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 4/20 0.58
USP2 O75604 1/20 0.58
MAPK1 P28482 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
ABCG2 Q9UNQ0 5/20 0.51
CYP2D6 P10635 2/20 0.47
LMNA P02545 1/20 0.47
HTR1A P08908 1/20 0.47
ADRA2A P08913 1/20 0.47
ADRA2C P18825 1/20 0.47
OPRK1 P41145 1/20 0.47
KCNH2 Q12809 1/20 0.47
EBP Q15125 1/20 0.47
SIGMAR1 Q99720 1/20 0.47
HRH3 Q9Y5N1 1/20 0.47
KMT2A Q03164 2/20 0.47
CYP2C19 P33261 1/20 0.45
ERN1 O75460 1/20 0.44
NFKB1 P19838 1/20 0.44
DPP4 P27487 1/20 0.44

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
SCHEMBL466144 0.80 CYP3A4 (0.60) CYP3A4USP2MAPK1SMN1; SMN2ABCG2
SCHEMBL4907666 0.80 CYP3A4 (0.60) CYP3A4USP2MAPK1SMN1; SMN2ABCG2
SCHEMBL2029772 0.80 CYP3A4 (0.78) CYP3A4USP2MAPK1SMN1; SMN2ABCG2
SCHEMBL9713491 0.78 CYP3A4 (0.58) CYP3A4USP2MAPK1SMN1; SMN2ABCG2
SCHEMBL9699067 0.78 CYP3A4 (0.58) CYP3A4USP2MAPK1SMN1; SMN2ABCG2
Methyl 2,4,6-Trimethoxybenzoate SCHEMBL2563067 0.78 CYP3A4 (0.58) CYP3A4USP2MAPK1SMN1; SMN2ABCG2
SCHEMBL4153927 0.78 CYP3A4 (0.58) CYP3A4USP2MAPK1SMN1; SMN2ABCG2
SCHEMBL2096044 0.78 CYP3A4 (0.58) CYP3A4USP2MAPK1SMN1; SMN2ABCG2
SCHEMBL2293547 0.78 CYP3A4 (0.53) CYP3A4USP2MAPK1SMN1; SMN2ABCG2
Phosphine SCHEMBL22499896 0.77 CYP3A4 (0.56) CYP3A4USP2MAPK1SMN1; SMN2ABCG2

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
WO-2023186782-A1 USE OF TETRAKISACYLGERMANES AS PHOTOINITIATORS TECHNISCHE UNIVERSITÄT WIEN (AT) 2023-10-05 WO disclosed
WO-2023186782-A1 USE OF TETRAKISACYLGERMANES AS PHOTOINITIATORS TECHNISCHE UNIVERSITÄT WIEN (AT) 2023-10-05 WO disclosed