SCHEMBL11568630

SCHEMBL11568630

CC(C)COc1ccc(C(C(=O)C(c2ccccc2)c2ccc(OCC(C)C)cc2O)c2ccccc2)c(O)c1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GPR88 Q9GZN0 4/20 0.44
TYR P14679 1/20 0.42
KAT6A Q92794 1/20 0.42
SIRT2 Q8IXJ6 1/20 0.41
MAPT P10636 2/20 0.41
POLB P06746 1/20 0.41
HPGD P15428 1/20 0.41
XBP1 P17861 1/20 0.41
FFAR1 O14842 1/20 0.40
RAB9A P51151 1/20 0.40
ALOX5 P09917 1/20 0.40
MAOB P27338 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
MDM2 Q00987 1/20 0.40
MCL1 Q07820 1/20 0.40
NR1H4 Q96RI1 2/20 0.39
LMNA P02545 1/20 0.39

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
SCHEMBL11566910 0.88 MAPK1 (0.49) GPR88TYRHPGDALOX5NR1H4
SCHEMBL11565256 0.88 CSNK1D (0.47) TYRMAPTPOLBHPGDRAB9A
SCHEMBL9059711 0.84 PTPN11 (0.47) GPR88MAPTRAB9AALOX5MAOB
SCHEMBL8983949 0.83 TYR (0.46) TYRKAT6AMAPTPOLBMEN1
SCHEMBL11559419 0.83 GAA (0.46) TYRMAOBLMNA
SCHEMBL11551597 0.82 PTPN11 (0.51) GPR88
SCHEMBL11558507 0.82 HPGD (0.50) TYRMAPTPOLBHPGDRAB9A
SCHEMBL787715 0.77 KDM4E (0.41) KAT6ASIRT2MAPTMAOBMDM2
SCHEMBL3453799 0.77 TYR (0.59) TYRMAPTRAB9AALOX5MEN1
SCHEMBL11833120 0.76 TYR (0.46) TYRMAPTHPGDMEN1KMT2A

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-4163746-A ANABOLIC, 5-METHYL-7-ALKOXYISOFLAVONES CHINOIN GYOGYSZER ES VEGYESZETI TERMEKEK GYARA RT. (HU) 1979-08-07 US disclosed