SCHEMBL20058771

SCHEMBL20058771

CC(C)CC(C)(C)NC(=O)N1Cc2ccccc2N=N1

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.35
NAMPT P43490 16/20 0.34
CARM1 Q86X55 1/20 0.32
KMT2A Q03164 1/20 0.31
PSMB1 P20618 1/20 0.31
PSMB2 P49721 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
SCHEMBL21991687 0.69 PDE3B (0.36) NAMPTKMT2A
SCHEMBL21183226 0.64 ASAH1 (0.51) KMT2A
SCHEMBL904823 0.60 SIGMAR1 (0.42) KMT2A
SCHEMBL7732342 0.60 SIGMAR1 (0.42) CARM1KMT2A
SCHEMBL11347558 0.57 SIGMAR1 (0.43) CARM1KMT2A
SCHEMBL23168321 0.57 CYP2C19 (0.41)
SCHEMBL13065932 0.57 MMP8 (0.36)
SCHEMBL4725456 0.57 SIGMAR1 (0.46) KMT2A
SCHEMBL4725450 0.57 SIGMAR1 (0.42) KMT2A
SCHEMBL4573279 0.57 SIGMAR1 (0.42) KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3309219-B1 ADDITION-CURABLE SILICONE RUBBER COMPOSITION AND CURED PRODUCT SHINETSU CHEMICAL CO (JP) 2019-07-24 EP disclosed
EP-3309219-A1 ADDITION-CURABLE SILICONE RUBBER COMPOSITION AND CURED PRODUCT Shin-Etsu Chemical Co., Ltd. (JP) 2018-04-18 EP disclosed