SCHEMBL11367182

SCHEMBL11367182

CCOCCSc1nc[nH]n1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 6/20 0.36
MAPK1 P28482 3/20 0.36
NPC1 O15118 3/20 0.36
RAB9A P51151 3/20 0.36
MAPT P10636 3/20 0.36
HPGD P15428 2/20 0.36
LMNA P02545 4/20 0.35
ALDH1A1 P00352 2/20 0.33
NPSR1 Q6W5P4 3/20 0.33
TDP1 Q9NUW8 3/20 0.33
HTT P42858 2/20 0.33
TP53 P04637 1/20 0.33
EGFR P00533 1/20 0.32
TUBB4A P04350 1/20 0.32
TUBB P07437 1/20 0.32
TUBA3C P0DPH7 1/20 0.32
TUBA1B P68363 1/20 0.32
TUBA4A P68366 1/20 0.32

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
SCHEMBL11375936 0.81 SMN1; SMN2 (0.38) MEN1KMT2ASMN1; SMN2MAPK1NPC1
SCHEMBL1763254 0.81
SCHEMBL17727009 0.76 USP2 (0.34) SMN1; SMN2NPC1RAB9AMAPTHPGD
SCHEMBL9836459 0.75 SMN1; SMN2 (0.50) MEN1KMT2ASMN1; SMN2MAPK1NPC1
SCHEMBL11510340 0.75 SMN1; SMN2 (0.50) MEN1KMT2ASMN1; SMN2MAPK1NPC1
SCHEMBL9175656 0.75 SMN1; SMN2 (0.50) MEN1KMT2ASMN1; SMN2MAPK1NPC1
SCHEMBL7817837 0.73
SCHEMBL687799 0.73
Bromide SCHEMBL11220167 0.69 DYRK3 (0.32) MEN1KMT2ASMN1; SMN2MAPTHPGD
SCHEMBL9888758 0.69 LMNA (0.39) MEN1KMT2ASMN1; SMN2MAPK1NPC1

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-4251262-A 1-Carbamoyl-1,2,4-triazole herbicidal agents THE BOOTS COMPANY LIMITED (GB) 1981-02-17 US disclosed