SCHEMBL19061599

SCHEMBL19061599

FC(F)(F)c1cccc(CSC2=NCN(Cc3cccnc3)CN2)c1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.53
▸ POLB P06746 1/20 0.53
▸ CYP3A4 P08684 1/20 0.47
▸ UBE2M P61081 3/20 0.44
▸ DCUN1D1 Q96GG9 3/20 0.44
▸ GRIN2B Q13224 4/20 0.43
▸ GRIN1 Q05586 3/20 0.43
▸ RAB9A P51151 1/20 0.42
▸ DAO P14920 1/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ GFER P55789 2/20 0.41
▸ GAA P10253 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.40
▸ PKM P14618 1/20 0.40

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
SCHEMBL19019919 0.90 HIF1A (0.47) KDM4EPOLBCYP3A4HSD17B10PKM
SCHEMBL19061459 0.86 RAB9A (0.46) KDM4EPOLBGRIN2BGRIN1RAB9A
SCHEMBL19061885 0.84 MEN1 (0.52) KDM4ECYP3A4GRIN2BGRIN1ALDH1A1
SCHEMBL19019917 0.84 TDP1 (0.46) KDM4EPOLBCYP3A4ALDH1A1HSD17B10
SCHEMBL19061887 0.84 L3MBTL1 (0.51) GRIN2BGRIN1RAB9ADAOHSD17B10
SCHEMBL19019922 0.84 MAPK1 (0.50) KDM4EPOLBRAB9AALDH1A1GAA
SCHEMBL19062037 0.83 METAP2 (0.43) KDM4EGRIN2BGRIN1ALDH1A1GFER
SCHEMBL19061954 0.83 HSD17B10 (0.42) KDM4EPOLBCYP3A4GRIN2BGRIN1
SCHEMBL19019870 0.82 CHRNB2 (0.43) KDM4EPOLBCYP3A4GRIN2BGRIN1
SCHEMBL19061730 0.82 KDM4E (0.41) KDM4EPOLBCYP3A4ALDH1A1HSD17B10

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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