SCHEMBL8065137

SCHEMBL8065137

O=C(O)c1ccccc1NC(=O)c1ncoc1-c1ccc(C(F)(F)F)cc1.[LiH]

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 1/20 0.53
KDM4E B2RXH2 4/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
ALDH1A1 P00352 2/20 0.49
HPGD P15428 2/20 0.49
HSD17B10 Q99714 2/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
LMNA P02545 2/20 0.47
TRPA1 O75762 1/20 0.47
TRPM8 Q7Z2W7 1/20 0.47
DHODH Q02127 1/20 0.47
MAPT P10636 2/20 0.45
KCNK2 O95069 1/20 0.45
KCNK10 P57789 1/20 0.45
CA12 O43570 1/20 0.44
CA2 P00918 1/20 0.44
CA9 Q16790 1/20 0.44
GRIK1 P39086 1/20 0.43
MAPK8 P45983 1/20 0.43

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
SCHEMBL8059444 0.99 GSK3B (0.54) GSK3BKDM4EMEN1KMT2AALDH1A1
Lithium Ion SCHEMBL8065141 0.88 GSK3B (0.53) GSK3BKDM4EMEN1KMT2AALDH1A1
SCHEMBL8065609 0.87 LMNA (0.64) GSK3BKDM4EMEN1KMT2AALDH1A1
SCHEMBL27541239 0.81 GSK3B (0.66) GSK3BKDM4EALDH1A1LMNA
SCHEMBL1167311 0.78 GSK3B (0.60) GSK3BKDM4EMEN1KMT2AADORA2A
SCHEMBL8060528 0.75 MEN1 (0.47) MEN1KMT2AALDH1A1HSD17B10TRPA1
SCHEMBL8065144 0.72 TRPA1 (0.53) LMNATRPA1TRPM8DHODHKCNK2
SCHEMBL8059585 0.72 GSK3B (0.58) GSK3BKDM4EADORA2A
SCHEMBL8065368 0.71 GSK3B (0.58) GSK3BKDM4EMEN1KMT2ALMNA
SCHEMBL2292297 0.69 KCNK2 (0.62) MEN1KMT2ASMN1; SMN2TRPA1TRPM8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6096770-A ADMINISTERING ORALLY OR PARENTALLY, TO A PATIENT AN ANTHRANILIC ACID DERIVATIVE FOR REDUCING THE ADVERSE EFFECTS OF SMOOTH MUSCLE CONTRACTIONS AMERICAN HOME PRODUCTS CORPORATION (US) 2000-08-01 US claimed
EP-1003713-A1 ANTHRANILIC ACID ANALOGS AMERICAN HOME PRODUCTS CORPORATION (US) 2000-05-31 EP claimed
WO-1999007670-A1 ANTHRANILIC ACID ANALOGS AMERICAN HOME PRODUCTS CORPORATION (US) 1999-02-18 WO claimed
US-6096770-A ADMINISTERING ORALLY OR PARENTALLY, TO A PATIENT AN ANTHRANILIC ACID DERIVATIVE FOR REDUCING THE ADVERSE EFFECTS OF SMOOTH MUSCLE CONTRACTIONS AMERICAN HOME PRODUCTS CORPORATION (US) 2000-08-01 US disclosed
EP-1003713-A1 ANTHRANILIC ACID ANALOGS AMERICAN HOME PRODUCTS CORPORATION (US) 2000-05-31 EP disclosed
WO-1999007670-A1 ANTHRANILIC ACID ANALOGS AMERICAN HOME PRODUCTS CORPORATION (US) 1999-02-18 WO disclosed