SCHEMBL10519986

SCHEMBL10519986

Cc1cnc2sc(Sc3ccc(Cl)cc3)nn2c1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 4/20 0.46
PKM P14618 4/20 0.46
RAB9A P51151 2/20 0.44
MAPT P10636 5/20 0.42
LMNA P02545 2/20 0.39
ALDH1A1 P00352 2/20 0.39
MEN1 O00255 1/20 0.39
USP2 O75604 1/20 0.39
HPGD P15428 1/20 0.39
KMT2A Q03164 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MAPK14 Q16539 1/20 0.39
GFER P55789 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
TP53 P04637 2/20 0.37
CYP3A4 P08684 2/20 0.36
CYP2C9 P11712 2/20 0.36
CYP2C19 P33261 2/20 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
SCHEMBL9533375 0.86 PKM (0.44) HTTPKMRAB9AMAPTLMNA
SCHEMBL9521763 0.70 PKM (0.70) HTTPKMRAB9AMAPTLMNA
SCHEMBL9532865 0.62 MEN1 (0.45) PKMRAB9AMAPTLMNAALDH1A1
SCHEMBL15349189 0.60 RAB9A (0.34) HTTPKMRAB9AMAPTCDK2
SCHEMBL18003576 0.59 MAPT (0.40) HTTMAPTLMNAALDH1A1MEN1
SCHEMBL18003363 0.59 ALDH1A1 (0.47) PKMRAB9AMAPTLMNAALDH1A1
SCHEMBL25994983 0.58 HAO1 (0.44) HTTMAPTLMNAALDH1A1MEN1
SCHEMBL7127591 0.58 KMT2A (0.48) HTTRAB9AMAPTLMNAALDH1A1
SCHEMBL8737436 0.57 L3MBTL1 (0.50) HTTRAB9AMAPTLMNAALDH1A1
SCHEMBL25353950 0.56 CA1 (0.41) HTTMAPTLMNAALDH1A1MEN1

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
JP-1083084-A None JP disclosed
JP-S6483084-A THIADIAZOLOPYRIMIDIN-5-ONE DERIVATIVE AND AGRICULTURAL AND HORTICULTURAL GERMICIDE KUMIAI CHEMICAL INDUSTRY CO 1989-03-28 JP disclosed