SCHEMBL4454308

SCHEMBL4454308

CCCCCCCCCCCCCCCCCCC([NH3+])CCCCCCCCCCCCCCCCCC.Cc1ccc([B-](c2ccc(C)cc2C)(c2ccc(C)cc2C)c2ccc(C)cc2C)c(C)c1

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 1/20 0.33
CNR1 P21554 1/20 0.32
CNR2 P34972 1/20 0.32
HTT P42858 1/20 0.31
TLR8 Q9NR97 1/20 0.31
KDM4E B2RXH2 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
SCHEMBL4453252 0.78 HTT (0.38) PDE5AHTT
SCHEMBL628541 0.77 DNM1 (0.34) CNR1CNR2HTTTLR8KDM4E
SCHEMBL29463888 0.77 DNM1 (0.34) CNR1CNR2HTTTLR8KDM4E
Propylamine SCHEMBL9067454 0.77 TDP1 (0.35)
SCHEMBL136071 0.76 KDM4E (0.33) HTTTLR8KDM4E
SCHEMBL30726899 0.76 KDM4E (0.33) HTTTLR8KDM4E
SCHEMBL4455875 0.74 SPHK1 (0.35) CNR1CNR2HTTKDM4E
SCHEMBL473095 0.74 TDP1 (0.46)
SCHEMBL31200864 0.73 TDP1 (0.35)
SCHEMBL5088803 0.73 TDP1 (0.35)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3778667-B1 4-METHYL-1-PENTENE POLYMER PARTICLES AND METHOD OF PRODUCING 4-METHYL-1-PENTENE RESIN MITSUI CHEMICALS INC (JP) 2025-09-03 EP disclosed
US-11485815-B2 4-methyl-1-pentene polymer particle and method for producing 4-methyl-1-pentene resin MITSUI CHEMICALS, INC. (JP) 2022-11-01 US disclosed
EP-3778667-A1 4-METHYL-1-PENTENE POLYMER PARTICLES AND METHOD OF PRODUCING 4-METHYL-1-PENTENE RESIN Mitsui Chemicals, Inc. (JP) 2021-02-17 EP disclosed
US-20210032397-A1 4-METHYL-1-PENTENE POLYMER PARTICLE AND METHOD FOR PRODUCING 4-METHYL-1-PENTENE RESIN MITSUI CHEMICALS, INC. (JP) 2021-02-04 US disclosed
US-20090137729-A1 Process for Producing Oriented Film MITSUI CHEMICALS, INC. (JP) 2009-05-28 US disclosed