SCHEMBL8946468

SCHEMBL8946468

COc1cc(C)c2c(c1)C1Cc3cccc(C)c3C1N2

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.34
MAOA P21397 1/20 0.34
DRD2 P14416 1/20 0.32
DRD1 P21728 1/20 0.32
DRD4 P21917 1/20 0.32
MEN1 O00255 3/20 0.32
KMT2A Q03164 3/20 0.32
MAPT P10636 2/20 0.32
ALDH1A1 P00352 2/20 0.32
HPGD P15428 1/20 0.32
GAA P10253 1/20 0.31
BRD4 O60885 1/20 0.31
CREBBP Q92793 1/20 0.31

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
SCHEMBL8946452 1.00 HTR2A (0.34) HTR2AMAOADRD2DRD1DRD4
SCHEMBL8946457 1.00 HTR2A (0.34) HTR2AMAOADRD2DRD1DRD4
SCHEMBL8946289 0.85 HTR2A (0.39) HTR2AMAOADRD1MEN1KMT2A
SCHEMBL8946281 0.85 HTR2A (0.39) HTR2AMAOADRD1MEN1KMT2A
SCHEMBL8946284 0.85 HTR2A (0.39) HTR2AMAOADRD1MEN1KMT2A
SCHEMBL8946557 0.77 MAPT (0.36) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL8946552 0.77 MAPT (0.36) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL8946559 0.77 MAPT (0.36) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL9844773 0.73 MTNR1A (0.39) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL9844738 0.72 HTR2A (0.40) HTR2AMAOAMAPTALDH1A1HPGD

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 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