SCHEMBL7785803

SCHEMBL7785803

C=CC(=O)Nc1ccc(N)cc1.Nc1ccc(N)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TGM2 P21980 13/20 0.66
F13A1 P00488 3/20 0.66
TGM1 P22735 3/20 0.66
LMNA P02545 2/20 0.66
TGM3 Q08188 1/20 0.66
MAPT P10636 1/20 0.59
RAB9A P51151 1/20 0.59
MEN1 O00255 1/20 0.53
POLB P06746 1/20 0.53
PKM P14618 1/20 0.53
APEX1 P27695 1/20 0.53
KMT2A Q03164 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
THRA P10827 1/20 0.50
THRB P10828 1/20 0.50
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA9 Q16790 1/20 0.46
EGFR P00533 1/20 0.44

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
SCHEMBL29054310 1.00 TGM2 (0.66) TGM2F13A1TGM1LMNATGM3
SCHEMBL6481884 1.00 TGM2 (0.66) TGM2F13A1TGM1LMNATGM3
SCHEMBL20469814 0.94 TGM2 (0.59) TGM2F13A1TGM1LMNATGM3
Acetic Acid SCHEMBL11194307 0.93 TGM2 (0.62) TGM2F13A1TGM1LMNATGM3
Dioxane SCHEMBL29080479 0.89 TGM2 (0.54) TGM2F13A1TGM1LMNATGM3
SCHEMBL439369 0.89 TGM2 (0.79) TGM2F13A1TGM1LMNATGM3
SCHEMBL964754 0.88 TGM2 (0.64) TGM2F13A1TGM1LMNATGM3
Pyridine SCHEMBL27849477 0.87 TGM2 (0.59) TGM2F13A1TGM1LMNATGM3
Aniline SCHEMBL28025728 0.86 TGM2 (0.81) TGM2F13A1TGM1LMNATGM3
SCHEMBL7845225 0.83 HPGD (0.56) TGM2F13A1TGM1LMNATGM3

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-1137633-A2 ACETAMIDE AND SUBSTITUTED ACETAMIDE-CONTAINING THIOUREA INHIBITORS OF HERPES VIRUSES AMERICAN HOME PRODUCTS CORPORATION (US) 2001-10-04 EP disclosed
WO-2000034237-A2 ACETAMIDE AND SUBSTITUTED ACETAMIDE-CONTAINING THIOUREA INHIBITORS OF HERPES VIRUSES AMERICAN HOME PRODUCTS CORPORATION (US) 2000-06-15 WO disclosed