SCHEMBL8565686

SCHEMBL8565686

Cc1nnc(NC(=O)Nc2ccc(F)c(Cl)c2)s1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 7/20 0.79
SMN1; SMN2 Q16637 4/20 0.79
POLB P06746 3/20 0.71
LMNA P02545 5/20 0.69
NPC1 O15118 3/20 0.69
RAB9A P51151 3/20 0.69
GAA P10253 2/20 0.69
MEN1 O00255 8/20 0.63
KMT2A Q03164 8/20 0.63
PTPRE P23469 1/20 0.60
SLC2A1 P11166 1/20 0.59
MAPT P10636 4/20 0.58
TP53 P04637 2/20 0.57
L3MBTL1 Q9Y468 1/20 0.57
BLM P54132 3/20 0.55
CASP3 P42574 1/20 0.54
SENP7 Q9BQF6 1/20 0.54
ALDH1A1 P00352 2/20 0.53
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52

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
SCHEMBL8569537 0.88 HTT (1.00) HTTSMN1; SMN2POLBLMNANPC1
SCHEMBL6379151 0.82 TAS1R3 (0.69) HTTSMN1; SMN2POLBLMNANPC1
SCHEMBL24232837 0.81 BLM (0.80) HTTSMN1; SMN2POLBLMNARAB9A
SCHEMBL8561964 0.77 HTT (0.75) HTTSMN1; SMN2POLBLMNANPC1
SCHEMBL14758505 0.76 MEN1 (0.75) HTTSMN1; SMN2LMNANPC1RAB9A
SCHEMBL5183426 0.76 MEN1 (0.79) HTTSMN1; SMN2LMNANPC1RAB9A
SCHEMBL14758344 0.76 SLC2A1 (1.00) HTTSMN1; SMN2LMNANPC1RAB9A
SCHEMBL11562419 0.75 SMN1; SMN2 (0.73) HTTSMN1; SMN2POLBLMNANPC1
SCHEMBL5183171 0.75 MEN1 (0.77) HTTSMN1; SMN2LMNANPC1RAB9A
SCHEMBL20910875 0.74 SLC2A1 (0.84) HTTSMN1; SMN2LMNANPC1RAB9A

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-5814646-A TREATING THE PROGRESSION OF ALZHEIMER'S DISEASE, BRAIN DISORDERS ELI LILLY AND COMPANY (US) 1998-09-29 US disclosed