SCHEMBL8890964

SCHEMBL8890964

CSc1oc(-c2ccccc2)nc1C(N)=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 1.00
HSD17B10 Q99714 4/20 1.00
PPARG P37231 1/20 1.00
NCOA2 Q15596 1/20 1.00
IKBKB O14920 9/20 0.63
ALDH1A1 P00352 4/20 0.48
HPGD P15428 3/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
MAPK1 P28482 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
TSHR P16473 2/20 0.47
LMNA P02545 1/20 0.47
HTT P42858 1/20 0.47
SLC9A1 P19634 1/20 0.46
TARBP2 Q15633 2/20 0.44

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
SCHEMBL167906 0.80 IKBKB (0.69) KDM4EHSD17B10PPARGNCOA2IKBKB
SCHEMBL31061359 0.78 IKBKB (1.00) KDM4EHSD17B10PPARGNCOA2IKBKB
SCHEMBL3124862 0.78 IKBKB (0.71) KDM4EHSD17B10PPARGNCOA2IKBKB
SCHEMBL8890199 0.75 IKBKB (0.61) KDM4EHSD17B10PPARGNCOA2IKBKB
SCHEMBL3124515 0.74 IKBKB (0.65) KDM4EHSD17B10PPARGNCOA2IKBKB
SCHEMBL31198739 0.73 IKBKB (0.63) KDM4EHSD17B10PPARGNCOA2IKBKB
SCHEMBL4741742 0.71 IKBKB (0.57) KDM4EHSD17B10PPARGNCOA2IKBKB
SCHEMBL3127593 0.71 IKBKB (0.67) KDM4EHSD17B10PPARGNCOA2IKBKB
SCHEMBL5013672 0.70 GAA (0.68) KDM4EHSD17B10PPARGNCOA2IKBKB
SCHEMBL2179708 0.69 TARBP2 (0.64) KDM4EHSD17B10PPARGNCOA2IKBKB

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
WO-1997024340-A1 OXAZOLE DERIVATIVES, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-07-10 WO disclosed