SCHEMBL28927870

SCHEMBL28927870

COC(C)Oc1ccccc1O[SiH2]CC(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.33
MTNR1A P48039 1/20 0.31
MTNR1B P49286 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
MCHR1 Q99705 1/20 0.30

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
SCHEMBL28290081 0.81 CA1 (0.50)
SCHEMBL28647704 0.78 KMT2A (0.35) KMT2AMTNR1AMTNR1B
SCHEMBL28665032 0.74 KMT2A (0.37) KMT2AMTNR1AMTNR1BNPSR1
SCHEMBL11653999 0.70 ALDH1A1 (0.48) KMT2ANPSR1MCHR1
SCHEMBL31360667 0.68 ADRA2A (0.49) KMT2ANPSR1
SCHEMBL28656466 0.68 TSHR (0.32) KMT2AMCHR1
SCHEMBL28938942 0.67 KMT2A (0.40) KMT2AMTNR1AMTNR1BNPSR1
SCHEMBL11586213 0.65 NISCH (0.45) KMT2A
SCHEMBL11654055 0.65 TDP1 (0.55)
SCHEMBL1592406 0.64 CA1 (0.65) KMT2AMTNR1AMTNR1B

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
CN-109715680-B Process for preparing high cis-1, 4-polydienes with lanthanide-based catalyst compositions 株式会社普利司通 2021-10-19 CN disclosed