SCHEMBL8946623

SCHEMBL8946623

CCN(CC)c1ccc2c(c1)C[C@@H]1c3ccccc3N[C@H]21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.43
MAPT P10636 6/20 0.43
MEN1 O00255 5/20 0.43
KMT2A Q03164 5/20 0.43
GAA P10253 4/20 0.43
L3MBTL1 Q9Y468 3/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
GRK6 P43250 1/20 0.43
HIF1A Q16665 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
KDM4E B2RXH2 2/20 0.42
LMNA P02545 2/20 0.42
HTT P42858 2/20 0.42
HPGD P15428 2/20 0.42
MAPK1 P28482 2/20 0.42
HSD17B10 Q99714 3/20 0.39
TP53 P04637 2/20 0.39
ALOX15 P16050 2/20 0.39
THRB P10828 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
SCHEMBL8946620 1.00 ALDH1A1 (0.43) ALDH1A1MAPTMEN1KMT2AGAA
SCHEMBL8946628 1.00 ALDH1A1 (0.43) ALDH1A1MAPTMEN1KMT2AGAA
SCHEMBL8946294 0.75 MAPT (0.50) ALDH1A1MAPTKMT2AGAAKDM4E
SCHEMBL277613 0.75 MAPT (0.50) ALDH1A1MAPTKMT2AGAAKDM4E
SCHEMBL8946291 0.75 MAPT (0.50) ALDH1A1MAPTKMT2AGAAKDM4E
SCHEMBL8946559 0.73 MAPT (0.36) ALDH1A1MAPTMEN1KMT2AGAA
SCHEMBL8946557 0.73 MAPT (0.36) ALDH1A1MAPTMEN1KMT2AGAA
SCHEMBL8946552 0.73 MAPT (0.36) ALDH1A1MAPTMEN1KMT2AGAA
SCHEMBL8946687 0.72 ALDH1A1 (0.36) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL8946675 0.72 ALDH1A1 (0.36) ALDH1A1MAPTMEN1KMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0409410-B1 Indenoindole compounds UNIV BATH (GB) 1996-03-20 EP claimed
US-5516788-A TREATMENT OF ATHEROSCLEROSIS; ANTIISCHEMIC, ANTICARCINOGENIC AGENTS; ANTICOAGULANTS UNIVERSITY OF BATH (GB) 1996-05-14 US disclosed
EP-0409410-B1 Indenoindole compounds UNIV BATH (GB) 1996-03-20 EP disclosed