SCHEMBL28899573

SCHEMBL28899573

COc1cc(OC)c(-c2ccccc2)cc1-c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGR P06401 1/20 0.54
CYP1A1 P04798 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2E1 P05181 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2C8 P10632 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2A6 P11509 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP4B1 P13584 1/20 0.48
CYP2B6 P20813 1/20 0.48
CYP3A5 P20815 1/20 0.48
CYP2A7 P20853 1/20 0.48
CYP3A7 P24462 1/20 0.48
CYP2F1 P24903 1/20 0.48
CYP2C18 P33260 1/20 0.48
CYP2C19 P33261 1/20 0.48
CYP2J2 P51589 1/20 0.48
CYP4F2 P78329 1/20 0.48
CYP4F8 P98187 1/20 0.48

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
SCHEMBL8501358 0.93 PGR (0.53) PGRCYP1A1CYP1A2CYP2E1CYP3A4
SCHEMBL24049723 0.93 PGR (0.56) PGRCYP1A1CYP1A2CYP2E1CYP3A4
SCHEMBL14027797 0.91 PGR (0.54) PGRCYP1A1CYP1A2CYP2E1CYP3A4
SCHEMBL24732303 0.87 PGR (0.49) PGRCYP1A1CYP1A2CYP2E1CYP3A4
SCHEMBL26259890 0.86 PGR (0.60) PGRCYP1A1CYP1A2CYP2E1CYP3A4
SCHEMBL19683672 0.86 PGR (0.60) PGRCYP1A1CYP1A2CYP2E1CYP3A4
SCHEMBL28157754 0.86 PGR (0.47) PGRCYP1A1CYP1A2CYP2E1CYP3A4
SCHEMBL16810204 0.85 PGR (0.58) PGRCYP1A1CYP1A2CYP2E1CYP3A4
SCHEMBL7649916 0.83 PGR (0.49) PGRCYP1A1CYP1A2CYP2E1CYP3A4
SCHEMBL8502642 0.83 PGR (0.49) PGRCYP1A1CYP1A2CYP2E1CYP3A4

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-115385955-A Tetrabiarylphosphine ligands and transition metal complexes thereof 东莞市均成高新材料有限公司 2022-11-25 CN disclosed