SCHEMBL8946439

SCHEMBL8946439

Cc1cc(C)c2c(c1)C1(C)Cc3ccccc3C1(C)N2

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.33
ADRA2A P08913 1/20 0.32
ADRA2B P18089 1/20 0.32
ADRA2C P18825 1/20 0.32
ADRA1B P35368 1/20 0.32
PDK2 Q15119 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
SCHEMBL8946432 1.00 KMT2A (0.33) KMT2AADRA2AADRA2BADRA2CADRA1B
SCHEMBL8946427 1.00 KMT2A (0.33) KMT2AADRA2AADRA2BADRA2CADRA1B
SCHEMBL8946400 0.84 BACE1 (0.34)
SCHEMBL8946395 0.84 BACE1 (0.34)
SCHEMBL8946403 0.84 BACE1 (0.34)
SCHEMBL8946842 0.81 S100B (0.35)
SCHEMBL8946828 0.81 S100B (0.35)
SCHEMBL8946834 0.81 S100B (0.35)
SCHEMBL8946532 0.78 CYP1A2 (0.33) ADRA2AADRA2BADRA2CADRA1B
SCHEMBL8946527 0.78 CYP1A2 (0.33) ADRA2AADRA2BADRA2CADRA1B

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
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
WO-1990015799-A1 INDENOINDOLE COMPOUNDS II UNIVERSITY OF BATH (GB) 1990-12-27 WO disclosed