SCHEMBL11487016

SCHEMBL11487016

CC(Cl)OC(C)Oc1ccc(Cl)cc1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.46
POLB P06746 1/20 0.43
GAA P10253 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
GPR55 Q9Y2T6 1/20 0.40
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
SIGMAR1 Q99720 4/20 0.37
P2RX3 P56373 1/20 0.37
PPARG P37231 2/20 0.36
PPARA Q07869 2/20 0.36
SLC6A4 P31645 1/20 0.36
MAP4K4 O95819 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
ADRB2 P07550 1/20 0.35

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
SCHEMBL17789998 0.85 L3MBTL1 (0.47) L3MBTL1POLBGAANPSR1GPR55
SCHEMBL6556332 0.84 L3MBTL1 (0.53) L3MBTL1POLBGAANPSR1GPR55
SCHEMBL10601649 0.82 POLB (0.48) L3MBTL1POLBGAANPSR1GPR55
SCHEMBL2870701 0.82 LDHA (0.41) L3MBTL1NPSR1PPARGPPARASLC6A4
SCHEMBL29167518 0.81 KDM4E (0.42) POLBGAACYP1A2CYP2C9CYP2C19
SCHEMBL29163216 0.80 L3MBTL1 (0.50) L3MBTL1POLBGAANPSR1GPR55
SCHEMBL9702616 0.78 P2RX3 (0.53) L3MBTL1POLBCYP1A2CYP2C9CYP2C19
SCHEMBL5289693 0.77 PPARG (0.49) L3MBTL1POLBNPSR1CYP1A2CYP2C9
SCHEMBL104891 0.75 P2RX3 (0.54) L3MBTL1POLBCYP1A2CYP2C9CYP2C19
SCHEMBL4192519 0.73 L3MBTL1 (0.45) L3MBTL1POLBGAANPSR1GPR55

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-4210657-A FUNGICIDES, BACTERICIDES SIEGFRIED AKTIENGESELLSCHAFT (CH) 1980-07-01 US disclosed