SCHEMBL7737490

SCHEMBL7737490

C=C(C)C(=O)OCCCCc1cc(Cc2cc(CCCCOC(=O)C(=C)C)cc(-n3nc4ccccc4n3)c2O)c(O)c(-n2nc3ccccc3n2)c1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.35
TDP1 Q9NUW8 3/20 0.35
APEX1 P27695 1/20 0.35
HTT P42858 1/20 0.35
NPC1 O15118 5/20 0.35
RAB9A P51151 5/20 0.35
ALDH1A1 P00352 4/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
TSHR P16473 2/20 0.34
KDM4E B2RXH2 3/20 0.32
LMNA P02545 2/20 0.32
MAPT P10636 3/20 0.32
HPGD P15428 3/20 0.32
TNKS2 Q9H2K2 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL7729403 0.97 NPC1 (0.36) POLBTDP1APEX1HTTNPC1
SCHEMBL7736250 0.93 NPC1 (0.37) POLBTDP1APEX1HTTNPC1
SCHEMBL7023514 0.92 TSHR (0.37) POLBNPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL7031867 0.92 NPC1 (0.42) POLBTDP1APEX1HTTNPC1
SCHEMBL7027240 0.92 TSHR (0.39) POLBNPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL7031681 0.91 TSHR (0.35) POLBTDP1NPC1RAB9AALDH1A1
SCHEMBL7736240 0.91 POLB (0.33) POLBTDP1APEX1HTTALDH1A1
SCHEMBL7029552 0.90 NPC1 (0.31) POLBTDP1APEX1HTTNPC1
SCHEMBL7737484 0.90 POLB (0.33) POLBTDP1APEX1HTTNPC1
SCHEMBL7026527 0.89 NPC1 (0.34) POLBTDP1NPC1RAB9AALDH1A1

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
US-6414100-B1 COMPOUND HAVING EXTREMELY LOW VAPOR PRESSURE AND HIGH DECOMPOSITION TEMPERATURE; CROSSLINKING AGENT FOR WEATHER RESISTANT POLYMERS OTSUKA CHEMICAL CO., LTD. (JP) 2002-07-02 US disclosed
EP-1055669-A1 BISBENZOTRIAZOLYLPHENOL COMPOUNDS, ULTRAVIOLET ABSORBER, ULTRAVIOLET-ABSORBING POLYMER, AND RESIN COMPOSITION AND COATING MATERIAL BOTH CONTAINING THESE OTSUKA CHEMICAL COMPANY, LIMITED (JP) 2000-11-29 EP disclosed