SCHEMBL8980541

SCHEMBL8980541

CC(C)Nc1nc(S)nc(S)n1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.52
TDP1 Q9NUW8 2/20 0.52
HTT P42858 3/20 0.46
MAPK1 P28482 2/20 0.46
LMNA P02545 2/20 0.46
F2 P00734 1/20 0.46
KMT2A Q03164 4/20 0.45
ALDH1A1 P00352 4/20 0.45
KDM4E B2RXH2 1/20 0.45
MEN1 O00255 2/20 0.43
CYP1A2 P05177 2/20 0.43
KCNH3 Q9ULD8 3/20 0.42
CYP2C19 P33261 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL11451349 0.86 GAA (0.45) GAATDP1HTTMAPK1LMNA
SCHEMBL10776025 0.81 GAA (0.41) GAATDP1HTTMAPK1LMNA
SCHEMBL11694657 0.81 GAA (0.57) GAATDP1HTTMAPK1LMNA
SCHEMBL8980528 0.80 TDP1 (0.33) GAATDP1HTTMAPK1LMNA
SCHEMBL8041736 0.80 GAA (0.74) GAATDP1HTTMAPK1LMNA
SCHEMBL23643386 0.80 KCNH3 (0.68) GAATDP1KMT2AMEN1KCNH3
SCHEMBL9333936 0.80 ALDH1A1 (0.47) GAATDP1HTTMAPK1LMNA
SCHEMBL14548976 0.77 L3MBTL1 (0.47) GAATDP1KMT2AALDH1A1MEN1
SCHEMBL22753513 0.74 GAA (0.58) GAATDP1HTTMAPK1LMNA
SCHEMBL9970677 0.72 GAA (0.56) GAATDP1HTTMAPK1LMNA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5569545-A LAMINATE HAVING COPPER FOIL WITH METAL ALLOY LAYER ON SIDE TO BE BONDED WITH INSULATING LAYER, SAID LAYERS BEING CROSSLINKED WITH EACH OTHER BY SULFUR BONDS NIPPON DENKAI LTD. (JP) 1996-10-29 US disclosed
US-4636550-A WITH SILICA AND OPTIONAL CARBON BLACK DEGUSSA AG (DE) 1987-01-13 US disclosed
US-4234341-A s-Triazine, process for producing it and its use for fireproofing polyester fiber materials CIBA-GEIGY CORPORATION (US) 1980-11-18 US disclosed
US-4165435-A SULFAMOYL OR SULFAMOYL-AMINO SUBSTITUTED; POLYESTERS CIBA-GEIGY CORPORATION (US) 1979-08-21 US disclosed