SCHEMBL8946508

SCHEMBL8946508

Cc1cc(C)c2c(c1)[C@@H]1Cc3ccccc3[C@@H]1N2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.40
ALDH1A1 P00352 2/20 0.40
KDM4E B2RXH2 1/20 0.40
LMNA P02545 1/20 0.40
HPGD P15428 1/20 0.40
MAPK1 P28482 1/20 0.40
HTT P42858 1/20 0.40
POLB P06746 1/20 0.34
KMT2A Q03164 2/20 0.33
HSPA1A P0DMV8 1/20 0.33
PTPN7 P35236 1/20 0.33
MEN1 O00255 1/20 0.33
GRIN2D O15399 1/20 0.33
GRIN3B O60391 1/20 0.33
GRIN1 Q05586 1/20 0.33
GRIN2A Q12879 1/20 0.33
GRIN2B Q13224 1/20 0.33
GRIN2C Q14957 1/20 0.33
GRIN3A Q8TCU5 1/20 0.33
TRPM5 Q9NZQ8 1/20 0.32

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
SCHEMBL8946516 1.00 MAPT (0.40) MAPTALDH1A1KDM4ELMNAHPGD
SCHEMBL8946512 1.00 MAPT (0.40) MAPTALDH1A1KDM4ELMNAHPGD
SCHEMBL8946281 0.83 HTR2A (0.39) MAPTALDH1A1KDM4ELMNAHPGD
SCHEMBL8946284 0.83 HTR2A (0.39) MAPTALDH1A1KDM4ELMNAHPGD
SCHEMBL8946289 0.83 HTR2A (0.39) MAPTALDH1A1KDM4ELMNAHPGD
SCHEMBL8946681 0.80 ALDH1A1 (0.36) MAPTALDH1A1KDM4ELMNAHPGD
SCHEMBL8946687 0.80 ALDH1A1 (0.36) MAPTALDH1A1KDM4ELMNAHPGD
SCHEMBL8946675 0.80 ALDH1A1 (0.36) MAPTALDH1A1KDM4ELMNAHPGD
SCHEMBL8946301 0.78 KDM4E (0.55) MAPTALDH1A1KDM4ELMNAHPGD
SCHEMBL8946297 0.78 KDM4E (0.55) MAPTALDH1A1KDM4ELMNAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0409410-B1 Indenoindole compounds UNIV BATH (GB) 1996-03-20 EP claimed
EP-0409410-A1 Indenoindole compounds UNIVERSITY OF BATH (GB) 1991-01-23 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
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