SCHEMBL8946552

SCHEMBL8946552

CCN(CC)c1ccc2c(c1)C[C@H]1c3cc(OC)cc(C)c3N[C@@H]21

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.36
LMNA P02545 5/20 0.36
HTT P42858 3/20 0.36
TP53 P04637 3/20 0.35
ALDH1A1 P00352 7/20 0.35
L3MBTL1 Q9Y468 5/20 0.35
HSD17B10 Q99714 4/20 0.35
GAA P10253 3/20 0.35
ALOX15 P16050 3/20 0.35
GFER P55789 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
NPSR1 Q6W5P4 2/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
HIF1A Q16665 2/20 0.33
MEN1 O00255 1/20 0.33
GRK6 P43250 1/20 0.33
KMT2A Q03164 1/20 0.33
CASP1 P29466 2/20 0.32
CASP7 P55210 2/20 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
SCHEMBL8946557 1.00 MAPT (0.36) MAPTLMNAHTTTP53ALDH1A1
SCHEMBL8946559 1.00 MAPT (0.36) MAPTLMNAHTTTP53ALDH1A1
SCHEMBL8946281 0.79 HTR2A (0.39) MAPTLMNAHTTALDH1A1MEN1
SCHEMBL8946284 0.79 HTR2A (0.39) MAPTLMNAHTTALDH1A1MEN1
SCHEMBL8946289 0.79 HTR2A (0.39) MAPTLMNAHTTALDH1A1MEN1
SCHEMBL8946452 0.77 HTR2A (0.34) MAPTALDH1A1GAAMEN1KMT2A
SCHEMBL8946457 0.77 HTR2A (0.34) MAPTALDH1A1GAAMEN1KMT2A
SCHEMBL8946468 0.77 HTR2A (0.34) MAPTALDH1A1GAAMEN1KMT2A
SCHEMBL8946687 0.76 ALDH1A1 (0.36) MAPTLMNAHTTALDH1A1MEN1
SCHEMBL8946675 0.76 ALDH1A1 (0.36) MAPTLMNAHTTALDH1A1MEN1

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