SCHEMBL11019474

SCHEMBL11019474

CCN(CC)c1sc(N)nc1C#N

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
KDM4E B2RXH2 3/20 0.32
MEN1 O00255 3/20 0.32
KMT2A Q03164 3/20 0.32
MAPT P10636 3/20 0.32
HPGD P15428 2/20 0.32
NPSR1 Q6W5P4 2/20 0.32
HSD17B10 Q99714 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
ALDH1A1 P00352 1/20 0.31
CASP1 P29466 1/20 0.31
CASP7 P55210 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
RECQL P46063 1/20 0.31

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
SCHEMBL11021326 0.86 MAPT (0.42) TSHRTDP1KDM4EMEN1KMT2A
SCHEMBL11022028 0.83 MAPT (0.40) KDM4EMEN1KMT2AMAPTHPGD
SCHEMBL11022531 0.78 USP8 (0.30)
SCHEMBL11021465 0.75 GAA (0.39) MAPT
SCHEMBL7537860 0.69
SCHEMBL5150808 0.68
Hydrochloric Acid SCHEMBL27560191 0.67 NOS1 (0.48) TSHRKDM4EMAPTHSD17B10SMN1; SMN2
SCHEMBL5537146 0.66 KDM4E (0.34) KDM4EMAPTHPGDHSD17B10SMN1; SMN2
SCHEMBL31016936 0.65
SCHEMBL11020657 0.65

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
EP-0160818-A1 Thiazole derivatives BASF Aktiengesellschaft (DE) 1985-11-13 EP disclosed