SCHEMBL9350650

SCHEMBL9350650

COC(=O)C(C)(C)OC(=O)c1cc(-n2c(=O)cc(C)n(C)c2=O)c(F)cc1Cl

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.33
POLB P06746 1/20 0.32
APEX1 P27695 1/20 0.32
MAPT P10636 2/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32
KMT2A Q03164 1/20 0.32
LMNA P02545 2/20 0.30
HPGD P15428 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
BAZ2B Q9UIF8 1/20 0.30
BAZ2A Q9UIF9 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HTT P42858 1/20 0.30

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
SCHEMBL6553915 0.92 CYP1A2 (0.32) POLBAPEX1MAPTCYP1A2CYP2C9
SCHEMBL6553643 0.90 BAZ2B (0.38) GAAMAPTCYP1A2CYP2C9KMT2A
SCHEMBL7547124 0.90 CYP1A2 (0.33) GAAPOLBAPEX1MAPTCYP1A2
SCHEMBL2968070 0.88 GAA (0.32) GAAPOLBAPEX1
SCHEMBL22745804 0.87 MAPT (0.36) GAAMAPTCYP1A2CYP2C9KMT2A
SCHEMBL9586647 0.85 BCAT2 (0.35) POLBMAPT
SCHEMBL6552592 0.83 BAZ2B (0.36) GAAMAPTCYP1A2CYP2C9KMT2A
SCHEMBL9351415 0.82 BAZ2B (0.33) GAAMAPTCYP1A2CYP2C9KMT2A
SCHEMBL9468954 0.80 MAPT (0.35) POLBMAPTCYP1A2CYP2C9KMT2A
SCHEMBL9567022 0.79 TSHR (0.35) POLBAPEX1MAPTCYP1A2CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0436680-B1 HETEROCYCLIC COMPOUNDS CIBA GEIGY AG (CH) 1994-09-07 EP claimed
WO-1991000278-A1 HETEROCYCLIC COMPOUNDS CIBA-GEIGY AG (CH) 1991-01-10 WO claimed
EP-0436680-B1 HETEROCYCLIC COMPOUNDS CIBA GEIGY AG (CH) 1994-09-07 EP disclosed
US-5183492-A Herbicides as enol ethers CIBA-GEIGY CORPORATION (US) 1993-02-02 US disclosed
WO-1991000278-A1 HETEROCYCLIC COMPOUNDS CIBA-GEIGY AG (CH) 1991-01-10 WO disclosed