SCHEMBL8777657

SCHEMBL8777657

CCCCN(CCCC)c1ccc(C2(c3c(C)n(CC)c4ccccc34)OC(=O)c3cccnc32)c(C)c1

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.34
LMNA P02545 2/20 0.34
POLB P06746 1/20 0.34
ALOX12 P18054 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
GPR55 Q9Y2T6 1/20 0.34
TP53 P04637 1/20 0.32
THRB P10828 1/20 0.32
KDM4E B2RXH2 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
GSK3A P49840 1/20 0.31
GSK3B P49841 1/20 0.31
HTT P42858 1/20 0.30
CHRM2 P08172 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL25190086 0.94 CNR2 (0.34) MAPTLMNAPOLBALOX12NPSR1
SCHEMBL25193611 0.93 MAPT (0.31) MAPTLMNATP53THRBGSK3A
SCHEMBL29385761 0.92 MAPT (0.36) MAPTLMNAPOLBALOX12NPSR1
SCHEMBL211573 0.92 MAPT (0.36) MAPTLMNAPOLBALOX12NPSR1
SCHEMBL30008910 0.92 MAPT (0.36) MAPTLMNAPOLBALOX12NPSR1
SCHEMBL3187050 0.91 LMNA (0.33) MAPTLMNATP53THRBSMN1; SMN2
SCHEMBL25189981 0.91 GSK3A (0.33) MAPTLMNAPOLBALOX12NPSR1
SCHEMBL8656463 0.89 ALDH1A1 (0.37) MAPTLMNAPOLBALOX12NPSR1
SCHEMBL25187498 0.89 GSK3A (0.34) MAPTLMNAPOLBTP53THRB
SCHEMBL31104737 0.89 CNR2 (0.34) MAPTLMNAPOLBALOX12NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023085225-A1 METHOD FOR MANUFACTURING RECYCLED RESIN COMPOSITION 住友化学株式会社 2023-05-19 WO disclosed
EP-0587184-B1 Pressure sensitive recording materials NEW OJI PAPER CO LTD (JP) 1997-12-29 EP disclosed
US-5478793-A Basic dye-containing layer and color accetpor-containing layer formed on same or different surfaces; basic dye enclosed in synthetic polymer microcapsules, color acceptor is activated clay containing silica KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1995-12-26 US disclosed
EP-0587184-A2 Pressure sensitive recording materials NEW OJI PAPER CO., LTD. (JP) 1994-03-16 EP disclosed