SCHEMBL10800511

SCHEMBL10800511

CCCCSc1nnc(NC(=O)NC)s1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.57
MAPT P10636 3/20 0.57
NPC1 O15118 3/20 0.57
SMN1; SMN2 Q16637 5/20 0.55
MEN1 O00255 4/20 0.55
KMT2A Q03164 4/20 0.55
HTT P42858 3/20 0.55
HIF1A Q16665 3/20 0.55
ALDH1A1 P00352 4/20 0.49
LMNA P02545 2/20 0.49
TP53 P04637 1/20 0.49
POLB P06746 1/20 0.49
MAPK1 P28482 1/20 0.48
GAA P10253 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2C19 P33261 1/20 0.46

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
SCHEMBL9720512 0.91 RAB9A (0.67) RAB9AMAPTNPC1SMN1; SMN2MEN1
SCHEMBL11540934 0.85 SMN1; SMN2 (0.66) RAB9AMAPTNPC1SMN1; SMN2MEN1
SCHEMBL13390710 0.82 HSD17B10 (0.57) RAB9AMAPTNPC1SMN1; SMN2MEN1
SCHEMBL10567617 0.80 ALDH1A1 (0.51) RAB9AMAPTNPC1SMN1; SMN2MEN1
SCHEMBL11625570 0.79 TP53 (0.61) RAB9AMAPTNPC1LMNATP53
SCHEMBL10889232 0.77 MAPT (0.63) RAB9AMAPTNPC1SMN1; SMN2MEN1
SCHEMBL10566898 0.77 RAB9A (0.56) RAB9AMAPTNPC1SMN1; SMN2MEN1
SCHEMBL8779347 0.76 RAB9A (0.63) RAB9AMAPTNPC1SMN1; SMN2MEN1
SCHEMBL11724223 0.74 ALDH1A1 (0.61) RAB9AMAPTNPC1SMN1; SMN2MEN1
SCHEMBL11718375 0.74 ALDH1A1 (0.61) RAB9AMAPTNPC1SMN1; SMN2MEN1

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
US-4639526-A HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 1987-01-27 US claimed