SCHEMBL21808459

SCHEMBL21808459

Cc1cc(C2CCCCCCCCCCC2)c(O)c(C)c1O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
MAPT P10636 1/20 0.42
KMT2A Q03164 1/20 0.42
PSMB5 P28074 2/20 0.38
ACHE P22303 1/20 0.36
NUDT1 P36639 1/20 0.36
BACE1 P56817 1/20 0.36
HSP90AA1 P07900 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
PTGDR2 Q9Y5Y4 1/20 0.35
NR1I2 O75469 1/20 0.34
KDM4B O94953 1/20 0.34
CHRM1 P11229 1/20 0.34
TBXA2R P21731 1/20 0.34
ADRA1A P35348 1/20 0.34
DOHH Q9BU89 1/20 0.34

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
SCHEMBL28386966 0.89 KDM4E (0.39) KDM4EMEN1MAPTKMT2APSMB5
SCHEMBL10698817 0.87 KDM4E (0.41) KDM4EMEN1MAPTKMT2APSMB5
SCHEMBL10697033 0.82 MEN1 (0.39) KDM4EMEN1MAPTKMT2APSMB5
SCHEMBL11793557 0.81 PSMB5 (0.49) KDM4EMEN1MAPTKMT2APSMB5
SCHEMBL10452977 0.81 PSMB5 (0.49) KDM4EMEN1MAPTKMT2APSMB5
SCHEMBL1245169 0.79 KDM4E (0.38) KDM4EMEN1MAPTKMT2APSMB5
SCHEMBL1244585 0.79 HSP90AA1 (0.38) KDM4EMEN1MAPTKMT2APSMB5
SCHEMBL11705589 0.79 KDM4E (0.38) KDM4EMEN1MAPTKMT2APSMB5
Methane SCHEMBL39470 0.79 PSMB5 (0.47) KDM4EMEN1MAPTKMT2APSMB5
Ethane SCHEMBL6550192 0.79 PSMB5 (0.47) KDM4EMEN1MAPTKMT2APSMB5

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
WO-2020060148-A1 POLYSILOXANE-POLYCARBONATE COPOLYMER HAVING HIGH IMPACT RESISTANCE, FLAME RESISTANCE AND TRANSPARENCY, AND PREPARATION METHOD THEREFOR 주식회사 삼양사 2020-03-26 WO disclosed