SCHEMBL7567776

SCHEMBL7567776

Cc1cc(N)c(Cl)cc1N.Nc1ccc(NC(=O)c2ccccc2F)cc1Cl.O=C(O)c1ccco1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
TDP1 Q9NUW8 1/20 0.50
RAB9A P51151 7/20 0.48
NPC1 O15118 6/20 0.48
MAPT P10636 6/20 0.48
HPGD P15428 4/20 0.48
SMN1; SMN2 Q16637 4/20 0.48
FADS1 O60427 1/20 0.47
ALOX15 P16050 1/20 0.45
ALOX12 P18054 1/20 0.45
CASP3 P42574 1/20 0.45
SENP8 Q96LD8 1/20 0.45
SENP7 Q9BQF6 1/20 0.45
SENP6 Q9GZR1 1/20 0.45
GAA P10253 1/20 0.45
ALDH1A1 P00352 6/20 0.45
LMNA P02545 3/20 0.45
HSD17B10 Q99714 2/20 0.45
USP2 O75604 1/20 0.45

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
SCHEMBL7078679 0.92 FADS1 (0.55) MEN1KMT2ATDP1RAB9ANPC1
SCHEMBL7567771 0.92 MEN1 (0.48) MEN1KMT2ATDP1RAB9ANPC1
SCHEMBL6819360 0.80 FADS1 (0.71) MEN1KMT2ATDP1RAB9ANPC1
SCHEMBL7785382 0.77 KMT2A (0.63) MEN1KMT2ATDP1RAB9ANPC1
SCHEMBL7911933 0.77 KMT2A (0.62) MEN1KMT2ATDP1RAB9ANPC1
SCHEMBL6816078 0.75 MEN1 (0.64) MEN1KMT2ATDP1RAB9ANPC1
SCHEMBL6815673 0.74 FADS1 (0.62) MEN1KMT2ATDP1RAB9ANPC1
SCHEMBL7573473 0.73 GFER (0.45) MEN1KMT2ATDP1RAB9ANPC1
SCHEMBL6815546 0.72 KMT2A (0.58) MEN1KMT2ATDP1RAB9ANPC1
SCHEMBL7860654 0.70 KMT2A (0.53) MEN1KMT2ATDP1RAB9ANPC1

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-1144399-A3 HETEROCYCLIC CARBOXAMIDE-CONTAINING THIOUREA INHIBITORS OF HERPES VIRUSES CONTAINING A SUBSTITUTED PHENYLENEDIAMINE GROUP Wyeth (US) 2002-09-11 EP disclosed
EP-1144399-A2 HETEROCYCLIC CARBOXAMIDE-CONTAINING THIOUREA INHIBITORS OF HERPES VIRUSES CONTAINING A SUBSTITUTED PHENYLENEDIAMINE GROUP AMERICAN HOME PRODUCTS CORPORATION (US) 2001-10-17 EP disclosed
EP-1137632-A1 THIOUREA INHIBITORS OF HERPES VIRUSES AMERICAN HOME PRODUCTS CORPORATION (US) 2001-10-04 EP disclosed
WO-2000034261-A2 HETEROCYCLIC CARBOXAMIDE-CONTAINING THIOUREA INHIBITORS OF HERPES VIRUSES CONTAINING A SUBSTITUTED PHENYLENEDIAMINE GROUP AMERICAN HOME PRODUCTS CORPORATION (US) 2000-06-15 WO disclosed
WO-2000034238-A1 THIOUREA INHIBITORS OF HERPES VIRUSES AMERICAN HOME PRODUCTS CORPORATION (US) 2000-06-15 WO disclosed