SCHEMBL9814263

SCHEMBL9814263

Oc1cccc(Cn2c(=S)sc3ccccc32)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.47
PKM P14618 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
MIF P14174 6/20 0.45
ALDH1A1 P00352 2/20 0.42
CYP1A2 P05177 1/20 0.42
HPGD P15428 1/20 0.42
HSD17B10 Q99714 1/20 0.42
LMNA P02545 1/20 0.40
TSHR P16473 1/20 0.40
HTT P42858 1/20 0.40
CXCR2 P25025 1/20 0.40
CD74 P04233 2/20 0.40
CHRNB2 P17787 1/20 0.39
CHRNA7 P36544 1/20 0.39
CHRNA4 P43681 1/20 0.39
MEN1 O00255 1/20 0.39
MAPT P10636 1/20 0.39
RECQL P46063 1/20 0.39
KMT2A Q03164 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
SCHEMBL9694879 0.84 L3MBTL1 (0.50) KDM4EPKML3MBTL1ALDH1A1CYP1A2
SCHEMBL11780045 0.83 L3MBTL1 (0.65) KDM4EPKML3MBTL1ALDH1A1CYP1A2
SCHEMBL9694402 0.76 L3MBTL1 (0.40) KDM4EPKML3MBTL1ALDH1A1CYP1A2
SCHEMBL9694360 0.76 F2R (0.43) KDM4EPKML3MBTL1ALDH1A1CYP1A2
SCHEMBL9694157 0.76 TSHR (0.54) KDM4EPKML3MBTL1ALDH1A1CYP1A2
SCHEMBL9692922 0.73 TP53 (0.39) KDM4EPKML3MBTL1ALDH1A1CYP1A2
SCHEMBL8079249 0.73 ALDH1A1 (0.51) KDM4EPKML3MBTL1ALDH1A1CYP1A2
SCHEMBL9692934 0.72 DRD2 (0.46) KDM4EPKML3MBTL1ALDH1A1CYP1A2
SCHEMBL9694913 0.72 L3MBTL1 (0.39) KDM4EPKML3MBTL1ALDH1A1CYP1A2
SCHEMBL17156136 0.71 MIF (0.72) MIFALDH1A1CD74MEN1MAPT

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-0259255-B1 PHENOLIC CORROSION INHIBITORS FOR PAINTS CIBA-GEIGY AG (CH) 1991-08-14 EP disclosed
US-4818777-A METAL PRIMERS CIBA-GEIGY CORPORATION (US) 1989-04-04 US disclosed