SCHEMBL569780

SCHEMBL569780

Cc1c(C(=O)O)n[nH]c1-c1ccsc1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.48
GPR35 Q9HC97 1/20 0.43
HCAR2 Q8TDS4 4/20 0.42
FYN P06241 3/20 0.40
DYRK1B Q9Y463 1/20 0.39
KDM4E B2RXH2 1/20 0.38
ACMSD Q8TDX5 1/20 0.38
IKBKB O14920 1/20 0.38
LCK P06239 1/20 0.37
DAO P14920 1/20 0.37
KIT P10721 2/20 0.36
FLT1 P17948 2/20 0.36
KDR P35968 2/20 0.36
DHODH Q02127 1/20 0.36
PTGER1 P34995 1/20 0.36

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
SCHEMBL570062 0.79 PIN1 (0.47) HCAR2KDM4E
SCHEMBL4964605 0.75 HAO2 (0.53) HCAR2
SCHEMBL16197762 0.75 ALPL (0.46) HCAR2KDM4EIKBKB
SCHEMBL570366 0.73 KMT2A (0.49) HCAR2KDM4EDAOKDR
SCHEMBL27658275 0.73 HAO2 (0.54) HCAR2KDM4E
SCHEMBL16883789 0.72 ALK (0.48) GPR35HCAR2KDM4EIKBKB
SCHEMBL2198685 0.71 IKBKB (0.43) HCAR2KDM4EIKBKB
SCHEMBL569461 0.71 PIN1 (0.56) HCAR2
SCHEMBL570152 0.70 HCAR2 (0.45) HCAR2DAOKIT
SCHEMBL569692 0.69 HCAR2 (0.41) GPR35HCAR2DYRK1BDAO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2601208-A2 LIGANDS FOR ANTIBODY AND Fc-FUSION PROTEIN PURIFICATION BY AFFINITY CHROMATOGRAPHY Graffinity Pharmaceuticals GmbH (DE) 2013-06-12 EP disclosed
WO-2012017021-A2 LIGANDS FOR ANTIBODY AND Fc-FUSION PROTEIN PURIFICATION BY AFFINITY CHROMATOGRAPHY GRAFFINITY PHARMACEUTICALS GMBH (DE) 2012-02-09 WO disclosed