SCHEMBL7879902

SCHEMBL7879902

FC(F)(F)c1cc(Br)c(Br)c(C(F)(F)F)c1C(F)(F)F

nearest known ligand 0.38

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 1/20 0.38
NOTUM Q6P988 1/20 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
SCHEMBL7931473 0.86 APEX1 (0.38) APEX1NOTUM
SCHEMBL7876486 0.73 NOTUM (0.36) NOTUM
SCHEMBL29702046 0.73 NOTUM (0.36) NOTUM
SCHEMBL23416481 0.73 GAA (0.35)
SCHEMBL2965251 0.73 NOTUM (0.41) NOTUM
SCHEMBL817540 0.72 KDM1A (0.38) NOTUM
SCHEMBL2954135 0.71 SOS1 (0.32) NOTUM
SCHEMBL4299413 0.70 NOTUM (0.36) NOTUM
SCHEMBL1042718 0.69 NOTUM (0.38) NOTUM
SCHEMBL28571888 0.67 APEX1 (0.30) APEX1

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
US-6326517-B1 REACTIN AN AROMATIC COMPOUND WITH CARBON MONOXIDE AND AMMONIA CENTRAL GLASS COMPANY, LIMITED (JP) 2001-12-04 US disclosed
US-6268527-B1 REACTING TRIFLUOROMETHYL SUBSTITUTED AROMATIC COMPOUND WITH CARBON MONOXIDE AND HYDROXY COMPOUND IN PRESENCE OF METAL COMPOUND AND PHOSPHINE DERIVATIVE TO PRODUCE TRIFLUOROMETHYL SUBSTITUTED BENZOIC ACID DERIVATIVE CENTRAL GLASS COMPANY, LIMITED (JP) 2001-07-31 US disclosed