SCHEMBL4455193

SCHEMBL4455193

CCCCCCCCCCCCCCCCCCC([NH3+])CCCCCCCCCCCCCCCCCC.Cc1ccccc1[B-](c1ccccc1C)(c1ccccc1C)c1ccccc1C

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK1E P49674 1/20 0.35
ALDH1A1 P00352 2/20 0.35
TP53 P04637 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
P2RX7 Q99572 1/20 0.33
PRSS1 P07477 1/20 0.33
PRSS2 P07478 1/20 0.33
PRSS3 P35030 1/20 0.33
OPRM1 P35372 2/20 0.32
OPRD1 P41143 2/20 0.32
OPRK1 P41145 2/20 0.32
OPRL1 P41146 2/20 0.32
CNR2 P34972 1/20 0.31
LIPG Q9Y5X9 1/20 0.30
NPC1 O15118 1/20 0.30
MITF O75030 1/20 0.30
GAA P10253 1/20 0.30
RAB9A P51151 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
Butylamine SCHEMBL2375340 0.78 DNM1 (0.34) ALDH1A1TP53MEN1KMT2AP2RX7
SCHEMBL30631951 0.77 ALDH1A1 (0.36) ALDH1A1TP53MEN1KMT2AP2RX7
SCHEMBL29575251 0.75 DNM1 (0.36) ALDH1A1TP53P2RX7LIPG
SCHEMBL628134 0.75 DNM1 (0.36) ALDH1A1TP53P2RX7LIPG
SCHEMBL4453252 0.73 HTT (0.38) CSNK1EMEN1KMT2ANPSR1L3MBTL1
SCHEMBL473106 0.72 TSHR (0.53) ALDH1A1
Octane SCHEMBL8046192 0.70 TSHR (0.59) ALDH1A1TP53MEN1KMT2AP2RX7
Decane SCHEMBL9863298 0.70 TSHR (0.59) ALDH1A1TP53MEN1KMT2AP2RX7
O-Xylene SCHEMBL7635740 0.70 TSHR (0.59) ALDH1A1TP53MEN1KMT2AP2RX7
Nonane SCHEMBL10943433 0.70 TSHR (0.59) ALDH1A1TP53MEN1KMT2AP2RX7

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