SCHEMBL29501464

SCHEMBL29501464

OC1CC(Nc2cc(NC3CCNCC3)ncn2)CC1N1CCc2ccccc2C1

nearest known ligand 0.50

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 16/20 0.50
WDR77 Q9BQA1 15/20 0.50
SLC18A3 Q16572 1/20 0.44

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
SCHEMBL25386006 0.84 PRMT5 (0.62) PRMT5WDR77
SCHEMBL26251193 0.84 PRMT5 (0.62) PRMT5WDR77
SCHEMBL30493050 0.84 PRMT5 (0.62) PRMT5WDR77
SCHEMBL26249406 0.80 PRMT5 (0.59) PRMT5WDR77
SCHEMBL25387648 0.80 PRMT5 (0.59) PRMT5WDR77
SCHEMBL29501361 0.80 PRMT5 (0.59) PRMT5WDR77
SCHEMBL25387641 0.80 PRMT5 (0.59) PRMT5WDR77
SCHEMBL26256529 0.80 PRMT5 (0.59) PRMT5WDR77
SCHEMBL25387714 0.79 PRMT5 (0.50) PRMT5WDR77
SCHEMBL25387099 0.78 NAE1 (0.48) PRMT5WDR77SLC18A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022048631-A1 COMPOUND HAVING ANTITUMOR ACTIVITY AND USE THEREOF 上海翊石医药科技有限公司 2022-03-10 WO disclosed