SCHEMBL2391032

SCHEMBL2391032

CCC(=Cc1cccc(-c2ccc(OCc3ccccc3)c(C34CC5CC(CC(C5)C3)C4)c2)c1)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC11 Q96DB2 4/20 0.46
RARB P10826 4/20 0.43
RARA P10276 3/20 0.43
RARG P13631 3/20 0.43
HDAC2 Q92769 1/20 0.42
LMNA P02545 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
NR1I2 O75469 1/20 0.42
PGR P06401 1/20 0.42
HSPD1 P10809 1/20 0.42
GOT1 P17174 1/20 0.42
GLRA1 P23415 1/20 0.42
BLM P54132 1/20 0.42
HSPE1 P61604 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
LTB4R Q15722 2/20 0.42
LTB4R2 Q9NPC1 2/20 0.42
HDAC1 Q13547 1/20 0.41
HDAC7 Q8WUI4 1/20 0.41

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
SCHEMBL14974248 0.89 HDAC11 (0.43) HDAC11RARBRARARARGHDAC2
SCHEMBL2391373 0.89 HDAC11 (0.43) HDAC11RARBRARARARGHDAC2
SCHEMBL2394296 0.89 HDAC11 (0.45) HDAC11RARBRARARARGHDAC2
SCHEMBL2390068 0.89 HDAC11 (0.43) HDAC11RARBRARARARGHDAC2
SCHEMBL2393669 0.89 HDAC11 (0.42) HDAC11RARBRARARARGHDAC2
SCHEMBL2395834 0.88 PTPN11 (0.48) HDAC11RARBRARARARGHDAC2
SCHEMBL2390729 0.88 HDAC11 (0.44) HDAC11RARBRARARARGHDAC2
SCHEMBL2393173 0.88 HDAC11 (0.42) HDAC11RARBRARARARGHDAC2
SCHEMBL2394235 0.88 HDAC11 (0.42) HDAC11RARBRARARARGHDAC2
SCHEMBL2387859 0.88 LMNA (0.45) HDAC11RARBRARARARGHDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE42700-E1 Induction of apoptosis in cancer cells SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE (US) 2011-09-13 US disclosed