SCHEMBL6643345

SCHEMBL6643345

Cc1nn(-c2ccccc2)c(C)c1Sc1nc[nH]n1.Cc1nn(-c2ccccc2)c(C)c1Sc1ncn(C(=O)N(C)C)n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.44
MAPT P10636 8/20 0.39
GAA P10253 6/20 0.39
TP53 P04637 3/20 0.39
POLB P06746 3/20 0.37
KDM4E B2RXH2 2/20 0.37
APEX1 P27695 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
RAB9A P51151 3/20 0.36
NPSR1 Q6W5P4 2/20 0.36
PDE4D Q08499 1/20 0.36
ALDH1A1 P00352 1/20 0.36
GFER P55789 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
VDR P11473 1/20 0.35
KLK6 Q92876 1/20 0.35
NPC1 O15118 2/20 0.35
TSHR P16473 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL5371737 0.91 LMNA (0.52) LMNAMAPTGAATP53POLB
SCHEMBL5381437 0.83 LMNA (0.60) LMNAMAPTGAATP53POLB
SCHEMBL7312272 0.77
SCHEMBL5380508 0.69 POLB (0.55) LMNAMAPTPOLBKDM4EAPEX1
SCHEMBL5381803 0.66 RORC (0.38) MAPTALDH1A1
SCHEMBL13510264 0.64 KEAP1 (0.49) LMNAMAPTGAAPOLBKDM4E
SCHEMBL5376606 0.64 KMT2A (0.42) LMNAGAATP53POLBKDM4E
SCHEMBL5376960 0.64 DAGLA (0.36) GAA
SCHEMBL5376216 0.64 NPC1 (0.52) KDM4ERAB9ANPSR1ALDH1A1SMN1; SMN2
SCHEMBL11376332 0.63 ACHE (0.36) KDM4EMEN1KMT2A

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-1258480-B1 Pharmaceutical use of N-Carbamoylazole derivatives EISAI CO LTD (JP) 2004-11-10 EP disclosed
EP-1258480-A1 Pharmaceutical use of N-Carbamoylazole derivatives Eisai Co., Ltd. (JP) 2002-11-20 EP disclosed