SCHEMBL27768365

SCHEMBL27768365

CN(C=O)c1nnc(Cc2ccsc2)c2cc(-c3ccc(Cl)cc3)sc12

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 1/20 0.35
FLT1 P17948 1/20 0.33
KDR P35968 1/20 0.33
NPC1 O15118 1/20 0.31
STK17B O94768 1/20 0.31
MAP3K8 P41279 1/20 0.31
PABPC1 P11940 1/20 0.31
KDM4E B2RXH2 1/20 0.30
LMNA P02545 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
MCHR1 Q99705 1/20 0.30

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
SCHEMBL27768559 0.84 MCHR1 (0.35) CHEK1FLT1KDRSTK17BMAP3K8
SCHEMBL29012242 0.83 FLT1 (0.42) CHEK1FLT1KDRLMNA
SCHEMBL13085878 0.81 NPC1 (0.36) CHEK1FLT1KDRNPC1STK17B
SCHEMBL12922010 0.81 CHEK1 (0.38) CHEK1NPC1STK17BMAP3K8KDM4E
SCHEMBL8827896 0.79 CHEK1 (0.47) CHEK1STK17BMAP3K8KDM4ERAB9A
SCHEMBL28776699 0.78 CHEK1 (0.34) CHEK1STK17BMAP3K8KDM4ELMNA
SCHEMBL12922012 0.78 GAA (0.40) CHEK1NPC1STK17BMAP3K8KDM4E
SCHEMBL29012212 0.77 CHEK1 (0.40) CHEK1KDRNPC1STK17BMAP3K8
SCHEMBL12922031 0.76 MAPT (0.42) STK17BLMNA
SCHEMBL28781348 0.74 MCHR1 (0.39) CHEK1MCHR1

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
CN-101481380-A Thiofuran pyridazine compound, preparation thereof, pharmaceutical composition and uses thereof ZHEJIANG MEDICINE CO LTD (CN) 2009-07-15 CN claimed
CN-101481380-A Thiofuran pyridazine compound, preparation thereof, pharmaceutical composition and uses thereof ZHEJIANG MEDICINE CO LTD (CN) 2009-07-15 CN disclosed