SCHEMBL19019922

SCHEMBL19019922

c1ccc(CSC2=NCN(Cc3cccnc3)CN2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 3/20 0.50
▸ CHRNB2 P17787 1/20 0.47
▸ CHRNA4 P43681 1/20 0.47
▸ KMT2A Q03164 2/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ HSD17B10 Q99714 1/20 0.43
▸ PKM P14618 1/20 0.43
▸ PLA2G7 Q13093 1/20 0.43
▸ TRPV6 Q9H1D0 1/20 0.43
▸ POLB P06746 1/20 0.42
▸ OPRM1 P35372 1/20 0.42
▸ OPRD1 P41143 1/20 0.42
▸ OPRK1 P41145 1/20 0.42
▸ OPRL1 P41146 1/20 0.42
▸ RAB9A P51151 1/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ GAA P10253 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL19019870 0.91 CHRNB2 (0.43) MAPK1CHRNB2CHRNA4KMT2AMEN1
SCHEMBL19061883 0.91 MEN1 (0.48) MAPK1CHRNB2CHRNA4KMT2AMEN1
SCHEMBL14286352 0.91 OPRK1 (0.48) MAPK1CHRNB2CHRNA4KMT2AMEN1
SCHEMBL19019834 0.91 PLA2G7 (0.47) MAPK1CHRNB2CHRNA4KMT2AMEN1
SCHEMBL19019907 0.89 LMNA (0.41) MAPK1CHRNB2CHRNA4KMT2AMEN1
SCHEMBL19019921 0.88 PKM (0.48) CHRNB2CHRNA4KMT2AMEN1HSD17B10
SCHEMBL19019919 0.88 HIF1A (0.47) MAPK1CHRNB2CHRNA4KMT2AMEN1
SCHEMBL19061740 0.88 NPC1 (0.46) MAPK1CHRNB2CHRNA4KMT2AMEN1
SCHEMBL19061954 0.87 HSD17B10 (0.42) MAPK1CHRNB2CHRNA4KMT2AMEN1
SCHEMBL19019915 0.87 TRPV6 (0.61) MAPK1KMT2AMEN1HSD17B10PKM

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
EP-3184514-A1 AUTOPHAGY INHIBITORS Deutsches Krebsforschungszentrum (DE) 2017-06-28 — — EP disclosed
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