SCHEMBL19062035

SCHEMBL19062035

Fc1ccc(CSC2=NCN(Cc3cccnc3)CN2)c(F)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 1/20 0.40
▸ ALDH1A1 P00352 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ CYP17A1 P05093 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ CHRNB2 P17787 1/20 0.39
▸ CHRNA4 P43681 1/20 0.39
▸ GRIN1 Q05586 2/20 0.38
▸ GRIN2B Q13224 2/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ PKM P14618 1/20 0.38
▸ CCNT1 O60563 1/20 0.38
▸ CDK9 P50750 1/20 0.38
▸ POLB P06746 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ GFER P55789 1/20 0.37
▸ PTK2 Q05397 1/20 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
SCHEMBL19061593 0.89 ALDH1A1 (0.46) HSD17B10ALDH1A1KDM4ETDP1KMT2A
SCHEMBL19061459 0.86 RAB9A (0.46) HSD17B10ALDH1A1KDM4EKMT2AMEN1
SCHEMBL19019870 0.86 CHRNB2 (0.43) HSD17B10ALDH1A1KDM4ETDP1KMT2A
SCHEMBL19061954 0.85 HSD17B10 (0.42) HSD17B10ALDH1A1KDM4ETDP1KMT2A
SCHEMBL19062037 0.83 METAP2 (0.43) HSD17B10ALDH1A1KDM4ETDP1KMT2A
SCHEMBL19061597 0.82 KDM4E (0.41) HSD17B10ALDH1A1KDM4EKMT2AMEN1
SCHEMBL19019922 0.81 MAPK1 (0.50) HSD17B10ALDH1A1KDM4ETDP1KMT2A
SCHEMBL19061477 0.81 LMNA (0.41) HSD17B10ALDH1A1KDM4ETDP1KMT2A
SCHEMBL19061888 0.81 ALDH1A1 (0.46) HSD17B10ALDH1A1KDM4ETDP1CYP3A4
SCHEMBL19062036 0.80 POLB (0.44) HSD17B10KDM4EKMT2AMEN1CHRNB2

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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