SCHEMBL23929137

SCHEMBL23929137

COc1cccc(CC(C)N)c1C

nearest known ligand 0.71

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.55
HTR2A P28223 2/20 0.53

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
SCHEMBL23929132 1.00 KMT2A (0.55) KMT2AHTR2A
SCHEMBL13744996 0.85 GABRA1 (0.48) KMT2A
SCHEMBL14655700 0.83 KMT2A (0.64) KMT2AHTR2A
SCHEMBL30249073 0.83 KMT2A (0.64) KMT2AHTR2A
SCHEMBL266563 0.83 KMT2A (0.64) KMT2AHTR2A
SCHEMBL1240176 0.83 KMT2A (0.47) KMT2A
SCHEMBL729393 0.82 KMT2A (0.55) KMT2AHTR2A
Iodide SCHEMBL28548071 0.81 KMT2A (0.62) KMT2AHTR2A
Hydrochloric Acid SCHEMBL30559568 0.81 KMT2A (0.67) KMT2AHTR2A
Hydrochloric Acid SCHEMBL28775228 0.81 KMT2A (0.67) KMT2AHTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115667275-B Boron-containing compounds and uses thereof 南京再明医药有限公司 2024-02-23 CN disclosed
CN-115667275-A Boron-containing compounds and their use 先声药业有限公司 2023-01-31 CN disclosed
WO-2021213358-A1 BORON-CONTAINING COMPOUNDS AND APPLICATION THEREOF 江苏先声药业有限公司 (CN) 2021-10-28 WO disclosed