SCHEMBL8946486

SCHEMBL8946486

COc1cc(C)c2c(c1)[C@@H]1c3ccccc3N[C@@H]1C2

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.35
ALDH1A1 P00352 2/20 0.35
HPGD P15428 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
BRD4 O60885 1/20 0.34
CREBBP Q92793 1/20 0.34
HTR2A P28223 1/20 0.33
MAOA P21397 1/20 0.33
LMNA P02545 1/20 0.33
TSHR P16473 1/20 0.33
KDM4E B2RXH2 1/20 0.33
GAA P10253 1/20 0.33
HTT P42858 1/20 0.33
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL8946478 1.00 MAPT (0.35) MAPTALDH1A1HPGDMEN1KMT2A
SCHEMBL8946494 1.00 MAPT (0.35) MAPTALDH1A1HPGDMEN1KMT2A
SCHEMBL8946487 0.78 HTR2A (0.46) MAPTALDH1A1HTR2A
SCHEMBL8946471 0.78 HTR2A (0.46) MAPTALDH1A1HTR2A
SCHEMBL8946481 0.78 HTR2A (0.46) MAPTALDH1A1HTR2A
SCHEMBL8946448 0.76 MAPT (0.34) MAPTALDH1A1MEN1KMT2AGAA
SCHEMBL8946454 0.76 MAPT (0.34) MAPTALDH1A1MEN1KMT2AGAA
SCHEMBL8946451 0.76 MAPT (0.34) MAPTALDH1A1MEN1KMT2AGAA
SCHEMBL10380867 0.71 ALDH1A1 (0.43) MAPTALDH1A1HPGDHTR2ALMNA
SCHEMBL8946685 0.70 MAPT (0.34) MAPTALDH1A1HPGDMEN1KMT2A

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
US-5516788-A TREATMENT OF ATHEROSCLEROSIS; ANTIISCHEMIC, ANTICARCINOGENIC AGENTS; ANTICOAGULANTS UNIVERSITY OF BATH (GB) 1996-05-14 US claimed
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
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