SCHEMBL10870076

SCHEMBL10870076

Cc1ccc(C)c(PC(=O)c2c(Cl)cccc2Cl)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.40
GAA P10253 3/20 0.39
POLB P06746 1/20 0.39
MAPT P10636 1/20 0.38
PTGS2 P35354 2/20 0.37
RAB9A P51151 3/20 0.37
LMNA P02545 2/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
TYK2 P29597 1/20 0.36
TAS1R3 Q7RTX0 1/20 0.36
TAS1R1 Q7RTX1 1/20 0.36
TAS1R2 Q8TE23 1/20 0.36
ABCB1 P08183 1/20 0.36
ITGB1 P05556 1/20 0.36
ITGA4 P13612 1/20 0.36
PBRM1 Q86U86 1/20 0.35
FABP3 P05413 1/20 0.35
FABP4 P15090 1/20 0.35

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
SCHEMBL7177506 0.98 ALDH1A1 (0.39) ALDH1A1GAAPOLBMAPTPTGS2
Lithium SCHEMBL7177510 0.98 ALDH1A1 (0.39) ALDH1A1GAAPOLBMAPTPTGS2
SCHEMBL7189939 0.94 TYK2 (0.39) ALDH1A1GAAPOLBMAPTPTGS2
Lithium SCHEMBL7189944 0.94 TYK2 (0.39) ALDH1A1GAAPOLBMAPTPTGS2
Lithium SCHEMBL7187695 0.89 MEN1 (0.40) ALDH1A1GAAMAPTRAB9ALMNA
SCHEMBL7187687 0.89 MEN1 (0.40) ALDH1A1GAAMAPTRAB9ALMNA
Lithium SCHEMBL7185641 0.86 ALDH1A1 (0.39) ALDH1A1GAAPOLBMAPTPTGS2
SCHEMBL7185635 0.86 ALDH1A1 (0.39) ALDH1A1GAAPOLBMAPTPTGS2
SCHEMBL7180684 0.85 S1PR4 (0.38) ALDH1A1GAAMEN1KMT2ACYP1A2
Lithium SCHEMBL7180693 0.85 S1PR4 (0.38) ALDH1A1GAAMEN1KMT2ACYP1A2

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-0184095-A2 Bisacylphosphinoxides, their preparation and use ESPE Stiftung & Co Produktions- und Vertriebs KG (DE) 1986-06-11 EP disclosed