SCHEMBL16441920

SCHEMBL16441920

Brc1cnc2sc3nc4ccccc4n3c2c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 4/20 0.52
KDM4E B2RXH2 3/20 0.52
SMN1; SMN2 Q16637 7/20 0.41
NPC1 O15118 5/20 0.41
RAB9A P51151 5/20 0.41
TP53 P04637 4/20 0.41
ENPP1 P22413 4/20 0.40
MAPT P10636 5/20 0.40
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
LMNA P02545 2/20 0.40
POLB P06746 2/20 0.40
PTPN7 P35236 3/20 0.39
DUSP3 P51452 2/20 0.39
MAPK1 P28482 3/20 0.38
TSHR P16473 2/20 0.38
HTT P42858 1/20 0.38
PTP4A3 O75365 1/20 0.38
PTP4A1 Q93096 1/20 0.38
HPGD P15428 3/20 0.37

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
SCHEMBL23504077 0.77 HSD17B10 (0.59) HSD17B10KDM4ESMN1; SMN2NPC1RAB9A
SCHEMBL16441961 0.77 HSD17B10 (0.46) HSD17B10KDM4ESMN1; SMN2NPC1RAB9A
SCHEMBL16432305 0.77 SMN1; SMN2 (0.48) HSD17B10KDM4ESMN1; SMN2NPC1RAB9A
SCHEMBL23504048 0.77 HSD17B10 (0.55) HSD17B10KDM4ESMN1; SMN2NPC1RAB9A
SCHEMBL16441964 0.76 KDM4E (0.45) HSD17B10KDM4ESMN1; SMN2NPC1RAB9A
SCHEMBL16441960 0.75 KDM4E (0.44) HSD17B10KDM4ESMN1; SMN2NPC1RAB9A
SCHEMBL18083389 0.74 HSD17B10 (0.62) HSD17B10KDM4ESMN1; SMN2NPC1RAB9A
SCHEMBL23504047 0.70 HSD17B10 (0.67) HSD17B10KDM4ESMN1; SMN2NPC1RAB9A
SCHEMBL30282194 0.70 SMN1; SMN2 (0.66) HSD17B10KDM4ESMN1; SMN2NPC1RAB9A
SCHEMBL16432493 0.70 SMN1; SMN2 (0.66) HSD17B10KDM4ESMN1; SMN2NPC1RAB9A

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
WO-2015014791-A1 BENZIMIDAZOLO[2,1-B][1,3]BENZOTHIAZOLES FOR ELECTRONIC APPLICATIONS BASF SE (DE) 2015-02-05 WO disclosed