SCHEMBL8384646

SCHEMBL8384646

Cc1c(Sc2nc3cc(Cl)ccc3[nH]2)ccnc1N

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MAP3K14 Q99558 2/20 0.39
KMT2A Q03164 3/20 0.39
MAPT P10636 2/20 0.39
ALDH1A1 P00352 2/20 0.39
MEN1 O00255 2/20 0.39
KDM4E B2RXH2 1/20 0.39
STAT3 P40763 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
PRKAG1 P54619 3/20 0.38
PRKAA2 P54646 3/20 0.38
PRKAB1 Q9Y478 3/20 0.38
RAB9A P51151 1/20 0.36
HSD17B10 Q99714 1/20 0.36
NPSR1 Q6W5P4 1/20 0.35
NR4A2 P43354 1/20 0.35
SOS2 Q07890 1/20 0.35
HTR3E A5X5Y0 1/20 0.35

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
SCHEMBL8381287 0.88 MAPT (0.40) SMN1; SMN2KMT2AMAPTALDH1A1MEN1
Water SCHEMBL8379647 0.86 MAPT (0.39) SMN1; SMN2KMT2AMAPTALDH1A1MEN1
SCHEMBL8384586 0.84 FABP6 (0.45) SMN1; SMN2KMT2AMAPTALDH1A1MEN1
SCHEMBL8380671 0.83 HTT (0.44) KMT2AMAPTALDH1A1MEN1RAB9A
SCHEMBL8379290 0.82 MEN1 (0.36) KMT2AMAPTALDH1A1MEN1KDM4E
SCHEMBL8379431 0.82 MAOA (0.37) KMT2AMAPTALDH1A1MEN1KDM4E
SCHEMBL8382787 0.82 KMT2A (0.58) HPGDSMN1; SMN2KMT2AMAPTALDH1A1
SCHEMBL8382700 0.81 KMT2A (0.51) HPGDSMN1; SMN2KMT2AMAPTALDH1A1
SCHEMBL8384667 0.81 RAB9A (0.46) HPGDSMN1; SMN2KMT2AMAPTALDH1A1
SCHEMBL8379364 0.80 ATP4A (0.38) HPGDKMT2AMAPTALDH1A1MEN1

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-5945425-A ADENOSINE TRIPHOSPHASE INHIBITOR; DNA VIRICIDE G.D. SEARLE & CO. (US) 1999-08-31 US disclosed