SCHEMBL6811795

SCHEMBL6811795

COc1ccccc1-c1cn(/N=C/c2ccccc2)c(N)n1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.64
TAAR1 Q96RJ0 1/20 0.64
ALDH1A1 P00352 5/20 0.63
MEN1 O00255 1/20 0.63
KMT2A Q03164 1/20 0.63
USP2 O75604 1/20 0.57
MAPK1 P28482 1/20 0.57
TLR8 Q9NR97 2/20 0.48
ADORA2A P29274 3/20 0.44
HSP90AA1 P07900 2/20 0.42
GAA P10253 4/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 1/20 0.41
HSP90AB1 P08238 1/20 0.41
LMNA P02545 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
TP53 P04637 1/20 0.40
MAPK10 P53779 1/20 0.40
DPP4 P27487 1/20 0.39

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
SCHEMBL6811797 1.00 MAPT (0.64) MAPTTAAR1ALDH1A1MEN1KMT2A
SCHEMBL6811402 0.87 MAPT (0.67) MAPTTAAR1ALDH1A1MEN1KMT2A
SCHEMBL6811399 0.87 MAPT (0.67) MAPTTAAR1ALDH1A1MEN1KMT2A
SCHEMBL7858387 0.78 MAPT (1.00) MAPTTAAR1ALDH1A1MEN1KMT2A
SCHEMBL6811992 0.77 MAPT (0.77) MAPTTAAR1ALDH1A1MEN1KMT2A
SCHEMBL6811998 0.77 MAPT (0.77) MAPTTAAR1ALDH1A1MEN1KMT2A
SCHEMBL6812622 0.76 MAPT (0.94) MAPTTAAR1ALDH1A1MEN1KMT2A
SCHEMBL6812618 0.76 MAPT (0.94) MAPTTAAR1ALDH1A1MEN1KMT2A
SCHEMBL6812347 0.75 MAPT (0.82) MAPTTAAR1ALDH1A1MEN1KMT2A
SCHEMBL6812342 0.75 MAPT (0.82) MAPTTAAR1ALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0808309-B1 IMIDAZOLE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS S-ADENOSYLMETHIONINE DECARBOXYLASE (=SAMDC) INHIBITORS NOVARTIS AG (CH) 2004-10-06 EP disclosed
US-5840911-A ANTIPROTOZOA, ANTITUMOR NOVARTIS AG (CH) 1998-11-24 US disclosed
EP-0808309-A1 IMIDAZOLE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS S-ADENOSYLMETHIONINE DECARBOXYLASE (=SAMDC) INHIBITORS Novartis AG (CH) 1997-11-26 EP disclosed
WO-1996022979-A1 IMIDAZOLE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS S-ADENOSYLMETHIONINE DECARBOXYLASE (=SAMDC) INHIBITORS NOVARTIS AG (CH) 1996-08-01 WO disclosed