SCHEMBL8946492

SCHEMBL8946492

CC(C)(C)c1ccc2c(c1)C1Cc3ccccc3C1N2

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.55
ALDH1A1 P00352 1/20 0.55
LMNA P02545 1/20 0.55
MAPT P10636 1/20 0.55
HPGD P15428 1/20 0.55
MAPK1 P28482 1/20 0.55
HTT P42858 1/20 0.55
KIF11 P52732 19/20 0.46

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
SCHEMBL8946530 1.00 KDM4E (0.55) KDM4EALDH1A1LMNAMAPTHPGD
SCHEMBL8946522 1.00 KDM4E (0.55) KDM4EALDH1A1LMNAMAPTHPGD
SCHEMBL28570817 0.86 KIF11 (0.47) KDM4EALDH1A1LMNAMAPTHPGD
SCHEMBL8946299 0.81 KDM4E (0.55) KDM4EALDH1A1LMNAMAPTHPGD
SCHEMBL8946297 0.81 KDM4E (0.55) KDM4EALDH1A1LMNAMAPTHPGD
SCHEMBL8946301 0.81 KDM4E (0.55) KDM4EALDH1A1LMNAMAPTHPGD
SCHEMBL8946294 0.78 MAPT (0.50) KDM4EALDH1A1LMNAMAPTHPGD
SCHEMBL8946291 0.78 MAPT (0.50) KDM4EALDH1A1LMNAMAPTHPGD
SCHEMBL277613 0.78 MAPT (0.50) KDM4EALDH1A1LMNAMAPTHPGD
SCHEMBL8946647 0.78 MAPT (0.55) KDM4EALDH1A1LMNAMAPTHPGD

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
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
EP-0409410-A1 Indenoindole compounds UNIVERSITY OF BATH (GB) 1991-01-23 EP disclosed
WO-1990015799-A1 INDENOINDOLE COMPOUNDS II UNIVERSITY OF BATH (GB) 1990-12-27 WO disclosed