SCHEMBL8621959

SCHEMBL8621959

CCC1CCCCC12C(=O)OC2=O

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 4/20 0.33
TP53 P04637 3/20 0.33
CYP3A4 P08684 3/20 0.33
HIF1A Q16665 2/20 0.33
LMNA P02545 2/20 0.33
CYP1A2 P05177 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
NFKB1 P19838 1/20 0.33
THPO P40225 1/20 0.33
PPM1B O75688 1/20 0.33
PTPN1 P18031 1/20 0.33
PPP1CC P36873 1/20 0.33
TFPI2 P48307 1/20 0.33
PPP5C P53041 1/20 0.33
PPP2CA P67775 1/20 0.33
PPP1CA P62136 1/20 0.33
KDM4E B2RXH2 1/20 0.33

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
SCHEMBL29291511 0.83 TDP1 (0.46) MAPK1TP53CYP3A4HIF1ALMNA
SCHEMBL6633941 0.82 TDP1 (0.33) MAPK1TDP1GAAHPGD
SCHEMBL8920552 0.80 TDP1 (0.40) TP53CYP1A2TDP1PTPN1HPGD
SCHEMBL8922321 0.80 TDP1 (0.40) TP53CYP1A2TDP1PTPN1HPGD
SCHEMBL8920841 0.80 TDP1 (0.40) TP53CYP1A2TDP1PTPN1HPGD
SCHEMBL8920942 0.80 TDP1 (0.40) TP53CYP1A2TDP1PTPN1HPGD
SCHEMBL8920526 0.80 TDP1 (0.40) TP53CYP1A2TDP1PTPN1HPGD
SCHEMBL28137355 0.77 GAA (0.50) MAPK1MAPTGAAHPGD
SCHEMBL1481003 0.75 TP53 (0.36) MAPK1TP53CYP3A4HIF1ALMNA
SCHEMBL16592474 0.74 TDP1 (0.31) TDP1

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-0608132-B1 Coating varnish composition and antifouling coating composition HITACHI CHEMICAL CO LTD (JP) 1998-05-20 EP disclosed
US-5439511-A Composition containing polymer obtained by polymerizing unsaturated acid anhydride and another unsaturated compound, specified additive HITACHI CHEMICAL COMPANY, LTD. (JP) 1995-08-08 US disclosed