SCHEMBL8425437

SCHEMBL8425437

Cc1cccc(C(C)Oc2ccc(C(C)c3cccc(C)c3)cc2C(=O)O)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 1/20 0.44
LTB4R2 Q9NPC1 1/20 0.44
RORC P51449 2/20 0.39
LRRK2 Q5S007 1/20 0.39
POLB P06746 3/20 0.38
ACP3 P15309 1/20 0.38
AKR1C2 P52895 3/20 0.36
AKR1C1 Q04828 1/20 0.36
KCNK3 O14649 1/20 0.36
KCNK9 Q9NPC2 1/20 0.36
KCNA5 P22460 1/20 0.36
KCNH2 Q12809 1/20 0.36
KCNB1 Q14721 1/20 0.36
NOTUM Q6P988 2/20 0.35
KDM4E B2RXH2 2/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 2/20 0.35
NPC1 O15118 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
SCHEMBL312341 0.86 LTB4R (0.53) LTB4RLTB4R2RORCLRRK2KDM4E
SCHEMBL9408339 0.85 LTB4R (0.52) LTB4RLTB4R2RORCLRRK2KDM4E
SCHEMBL8373824 0.85 LTB4R (0.44) LTB4RLTB4R2RORCLRRK2AKR1C2
SCHEMBL8428203 0.85 POLB (0.47) LTB4RLTB4R2RORCPOLBACP3
SCHEMBL10591294 0.82 LTB4R (0.54) LTB4RLTB4R2RORCLRRK2KDM4E
SCHEMBL9651898 0.80 KDM4E (0.45) LTB4RLTB4R2RORCLRRK2KDM4E
SCHEMBL5697821 0.79 CSNK2A1 (0.57) POLBACP3AKR1C2AKR1C1KDM4E
SCHEMBL6265906 0.75 KCNK3 (0.44) RORCACP3KCNK3KCNK9ALDH1A1
SCHEMBL5710470 0.75 KDM4E (0.49) LTB4RLTB4R2RORCKDM4EMEN1
SCHEMBL9810575 0.75 ALDH1A1 (0.53) POLBKDM4EMEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0547629-B2 Color developers and sheets thereof SANYO CHEMICAL IND LTD (JP) 1999-10-27 EP disclosed
US-5382560-A Metal salt of styrene-salicyclic acid compound SANYO CHEMICAL INDUSTRIES, LTD. (JP) 1995-01-17 US disclosed
EP-0547629-A1 Color developers and sheets thereof SANYO CHEMICAL INDUSTRIES, LTD. (JP) 1993-06-23 EP disclosed