SCHEMBL8779385

SCHEMBL8779385

CC(=O)CNc1nnc(SCc2ccccc2)s1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.58
KMT2A Q03164 4/20 0.58
SMN1; SMN2 Q16637 3/20 0.58
KDM4E B2RXH2 2/20 0.58
GAA P10253 2/20 0.58
ALDH1A1 P00352 2/20 0.58
RECQL P46063 1/20 0.58
FFAR1 O14842 1/20 0.57
MAPK1 P28482 1/20 0.57
ABL1 P00519 3/20 0.57
SRC P12931 3/20 0.57
ABCC8 Q09428 4/20 0.57
KCNJ11 Q14654 4/20 0.57
HPGD P15428 2/20 0.56
HSD17B10 Q99714 1/20 0.56
CA1 P00915 2/20 0.56
LMNA P02545 2/20 0.56
CYP1A2 P05177 1/20 0.55
CYP2C19 P33261 1/20 0.55
HTT P42858 1/20 0.55

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
SCHEMBL3612969 0.84 SMN1; SMN2 (0.76) MEN1KMT2ASMN1; SMN2KDM4EGAA
SCHEMBL8779355 0.79 RAB9A (0.70) MEN1KMT2ASMN1; SMN2KDM4EGAA
SCHEMBL11440911 0.79 CA1 (0.66) MEN1KMT2ASMN1; SMN2KDM4EGAA
SCHEMBL8779366 0.77 ABL1 (0.84) MEN1KMT2ASMN1; SMN2KDM4EGAA
SCHEMBL9403495 0.76 SMN1; SMN2 (0.56) MEN1KMT2ASMN1; SMN2KDM4EGAA
SCHEMBL28451175 0.76 ABL1 (0.67) MEN1KMT2ASMN1; SMN2KDM4EGAA
SCHEMBL8779318 0.75 ABL1 (0.65) MEN1KMT2ASMN1; SMN2KDM4EGAA
SCHEMBL3263155 0.74 LMNA (0.72) MEN1KMT2ASMN1; SMN2KDM4EGAA
SCHEMBL7483795 0.73 MEN1 (0.65) MEN1KMT2ASMN1; SMN2KDM4EGAA
SCHEMBL8779324 0.73 ALDH1A1 (0.59) MEN1KMT2ASMN1; SMN2KDM4EGAA

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-0579129-B1 Thiadiazole derivatives for the treatment of depressive states CT LAB FARM SRL (IT) 1997-03-05 EP disclosed
US-5401853-A Thiadiazole derivatives for the treatment of depressive states LABORATORIO FARMACEUTICO C.T. S.R.L. (IT) 1995-03-28 US disclosed