SCHEMBL8599534

SCHEMBL8599534

CC(C)n1c(C(F)(F)F)nc2c(NC(=O)c3c(Cl)cccc3Cl)cccc21

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.41
TYK2 P29597 1/20 0.41
PTGES O14684 13/20 0.39
ITGB1 P05556 1/20 0.38
ITGA4 P13612 1/20 0.38
MEN1 O00255 1/20 0.38
CRHBP P24387 1/20 0.38
HTT P42858 1/20 0.38
KMT2A Q03164 1/20 0.38
CRHR2 Q13324 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TRPV1 Q8NER1 1/20 0.38
LCK P06239 1/20 0.38

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
SCHEMBL8601415 0.91 LMNA (0.46) LMNATYK2PTGESITGB1ITGA4
SCHEMBL8601960 0.86 LMNA (0.41) LMNAPTGESITGB1ITGA4MEN1
SCHEMBL8598365 0.85 TYK2 (0.44) TYK2PTGESMEN1CRHBPHTT
SCHEMBL8602408 0.83 TP53 (0.39) LMNATYK2PTGESITGB1ITGA4
SCHEMBL8599739 0.83 KMT2A (0.41) LMNAPTGESKMT2ASMN1; SMN2
SCHEMBL8596747 0.83 LMNA (0.42) LMNAPTGES
SCHEMBL8598941 0.82 TYK2 (0.43) TYK2PTGESMEN1CRHBPHTT
SCHEMBL8597841 0.81 PTGES (0.37) TYK2PTGES
SCHEMBL8598883 0.81 TYK2 (0.44) LMNATYK2PTGESITGB1ITGA4
SCHEMBL8596165 0.81 TP53 (0.45) TYK2PTGESMEN1CRHBPHTT

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
EP-0863881-A1 BENZIMIDAZOLE DERIVATIVES AND THEIR USE IN THE PREVENTION AND/OR THE TREATMENT OF BONE DISEASES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-09-16 EP disclosed
WO-1997010219-A1 BENZIMIDAZOLE DERIVATIVES AND THEIR USE IN THE PREVENTION AND/OR THE TREATMENT OF BONE DISEASES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-03-20 WO disclosed