SCHEMBL19061459

SCHEMBL19061459

Fc1cccc(CSC2=NCN(Cc3cccnc3)CN2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 4/20 0.46
▸ SMN1; SMN2 Q16637 3/20 0.46
▸ TP53 P04637 1/20 0.46
▸ ALDH1A1 P00352 5/20 0.45
▸ KMT2A Q03164 4/20 0.45
▸ MAPT P10636 1/20 0.45
▸ GFER P55789 1/20 0.45
▸ KDM4E B2RXH2 2/20 0.42
▸ RXFP1 Q9HBX9 1/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ HPGD P15428 1/20 0.42
▸ GRIN1 Q05586 1/20 0.41
▸ GRIN2B Q13224 1/20 0.41
▸ PKM P14618 2/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ CHRNB2 P17787 1/20 0.41
▸ CHRNA4 P43681 1/20 0.41
▸ MEN1 O00255 3/20 0.41
▸ MAPK1 P28482 2/20 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
SCHEMBL19061954 0.92 HSD17B10 (0.42) RAB9ASMN1; SMN2TP53ALDH1A1KMT2A
SCHEMBL19019870 0.89 CHRNB2 (0.43) RAB9ASMN1; SMN2TP53ALDH1A1KMT2A
SCHEMBL19062037 0.88 METAP2 (0.43) ALDH1A1KMT2AMAPTGFERKDM4E
SCHEMBL19061887 0.87 L3MBTL1 (0.51) RAB9AKMT2AMAPTLMNAGRIN1
SCHEMBL19061885 0.87 MEN1 (0.52) ALDH1A1KMT2AKDM4ELMNAHPGD
SCHEMBL19019917 0.87 TDP1 (0.46) ALDH1A1KMT2AKDM4EHPGDPKM
SCHEMBL19061947 0.86 P2RX7 (0.44) RAB9ASMN1; SMN2TP53ALDH1A1KMT2A
SCHEMBL19061599 0.86 KDM4E (0.53) RAB9AALDH1A1GFERKDM4EGRIN1
SCHEMBL19062035 0.86 HSD17B10 (0.40) ALDH1A1KMT2AMAPTGFERKDM4E
SCHEMBL19019922 0.86 MAPK1 (0.50) RAB9ASMN1; SMN2ALDH1A1KMT2AKDM4E

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
Send feedback