SCHEMBL11114736

SCHEMBL11114736

CC(CCCC(C)(C)c1ccc(O)cc1O)CCC(C(=O)O)c1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TYR P14679 1/20 0.37
HSD17B10 Q99714 2/20 0.35
LMNA P02545 2/20 0.35
PDK1 Q15118 1/20 0.34
MAPK14 Q16539 1/20 0.33
PTGS1 P23219 1/20 0.33
CYP2C19 P33261 1/20 0.33
TBXAS1 P24557 2/20 0.32
POLB P06746 2/20 0.32
MEN1 O00255 1/20 0.32
APEX1 P27695 1/20 0.32
KMT2A Q03164 1/20 0.32
CTDSP1 Q9GZU7 1/20 0.32
CYP2C9 P11712 1/20 0.32
RIPK1 Q13546 1/20 0.31
KIF11 P52732 1/20 0.31
HIF1A Q16665 1/20 0.31
CNR1 P21554 1/20 0.31
CNR2 P34972 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
SCHEMBL11111809 0.86 ACE2 (0.41) TYRHSD17B10LMNAMAPK14POLB
SCHEMBL11116137 0.81 ALDH1A1 (0.39) TYRMAPK14POLBMEN1APEX1
SCHEMBL11118277 0.81 CA2 (0.37) TYRHSD17B10LMNAPOLBMEN1
SCHEMBL11111788 0.79 ACE2 (0.44) TYRLMNAMEN1KMT2ACNR1
SCHEMBL10729600 0.78 EGFR (0.43) LMNACYP2C19CNR2
SCHEMBL11115197 0.78 FOLH1 (0.39) TYRPOLBMEN1APEX1KMT2A
SCHEMBL10727308 0.78 TYR (0.36) TYRHSD17B10LMNAPOLBMEN1
SCHEMBL10726409 0.76 ALDH1A1 (0.39) LMNAKMT2A
SCHEMBL11112231 0.76 MEN1 (0.33) TYRPOLBMEN1APEX1KMT2A
SCHEMBL10732226 0.75 EGFR (0.41) TYRPOLBMEN1APEX1KMT2A

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
EP-0069066-B1 RESORCINOLS AND THEIR PREPARATION CIBA-GEIGY AG (CH) 1984-10-03 EP disclosed