SCHEMBL6971843

SCHEMBL6971843

CSc1sc(C(N)=O)c(C)c1-c1cc(C)no1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNC P24863 5/20 0.45
CDK8 P49336 5/20 0.45
CDK19 Q9BWU1 5/20 0.45
GAA P10253 1/20 0.43
CDK9 P50750 1/20 0.40
KDM4E B2RXH2 3/20 0.36
USP2 O75604 1/20 0.36
ALDH1A1 P00352 1/20 0.36
TSHR P16473 1/20 0.36
KMT2A Q03164 2/20 0.34
MAPT P10636 2/20 0.34
MEN1 O00255 1/20 0.34
LMNA P02545 1/20 0.34
POLB P06746 1/20 0.34
HCAR2 Q8TDS4 1/20 0.34
CSF1R P07333 5/20 0.34
AR P10275 1/20 0.34
IKBKB O14920 1/20 0.33
LIMK1 P53667 1/20 0.33
S100A4 P26447 1/20 0.33

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
SCHEMBL6968247 0.88 GAA (0.43) CCNCCDK8CDK19GAAKDM4E
SCHEMBL6978994 0.85 CCNC (0.43) CCNCCDK8CDK19GAAKDM4E
SCHEMBL6970409 0.84 GAA (0.44) CCNCCDK8CDK19GAAKDM4E
SCHEMBL6978646 0.75 CCNC (0.59) CCNCCDK8CDK19GAACDK9
SCHEMBL6980131 0.74 CCNC (0.55) CCNCCDK8CDK19GAACDK9
SCHEMBL6967359 0.72 CCNC (0.56) CCNCCDK8CDK19GAACDK9
SCHEMBL8195226 0.70 GAA (0.43) CCNCCDK8CDK19GAACDK9
SCHEMBL6975301 0.68 CCNC (0.51) CCNCCDK8CDK19GAACDK9
SCHEMBL7980960 0.65 KDM4E (0.39) KDM4EUSP2ALDH1A1TSHRKMT2A
SCHEMBL7981965 0.64 MAPT (0.37) KDM4EUSP2ALDH1A1TSHRKMT2A

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-1120415-B1 SUBSTITUTED ISOXAZOLYLTHIOPHENE COMPOUNDS TAISHO PHARMACEUTICAL CO LTD (JP) 2003-07-23 EP disclosed
US-6355663-B1 AN ENHANCING AGENT FOR THE ACTION OF CELL DIFFERENTIATION INDUCTION FACTORS FOR BONE DISORDERS AND NERVOUS SYSTEM DISORDERS TAISHO PHARMACEUTICAL CO., LTD. (JP) 2002-03-12 US disclosed
EP-1120415-A1 SUBSTITUTED ISOXAZOLYLTHIOPHENE COMPOUNDS TAISHO PHARMACEUTICAL CO., LTD (JP) 2001-08-01 EP disclosed