SCHEMBL27699050

SCHEMBL27699050

CSC(=N)Nc1ccc(CN)cc1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PLG P00747 8/20 0.44
KLKB1 P03952 7/20 0.44
PLAU P00749 2/20 0.44
PLAT P00750 1/20 0.44
PRSS1 P07477 1/20 0.44
F10 P00742 1/20 0.44
LOXL2 Q9Y4K0 1/20 0.44
KLK1 P06870 7/20 0.42
KLK6 Q92876 6/20 0.42
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
KMT2A Q03164 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ABAT P80404 1/20 0.40
SMYD3 Q9H7B4 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
SCHEMBL7877522 0.80 LOXL2 (0.47) PLGKLKB1PLAUPLATPRSS1
SCHEMBL7785365 0.79 TPSAB1 (0.52) PLGKLKB1PRSS1F10LOXL2
SCHEMBL327252 0.78 LOXL2 (0.54) PLGKLKB1PLAUPLATPRSS1
SCHEMBL12049311 0.77 PLG (0.49) PLGKLKB1PLAUPLATPRSS1
Hydrochloric Acid SCHEMBL7443406 0.76 LOXL2 (0.52) PLGKLKB1PLAUPLATPRSS1
Hydrochloric Acid SCHEMBL4888001 0.76 PLG (0.50) PLGKLKB1PLAULOXL2KLK1
SCHEMBL14949457 0.75 MAPT (0.50) KDM4EMEN1NPC1RAB9AKMT2A
SCHEMBL28819098 0.74 PLG (0.45) PLGKLKB1PLAUPLATPRSS1
SCHEMBL319880 0.74 KMT2A (0.47) MEN1NPC1RAB9AKMT2ASMN1; SMN2
SCHEMBL7670022 0.74 ALDH1A1 (0.48) KDM4EMEN1NPC1RAB9AKMT2A

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
CN-87102765-A The preparation method of sweeting agent N-guanidines guanidine-acetic acid and N-phenyl ethanamidine guanidine-acetic acid derivative and the prescription of this class sweeting agent 1987-10-21 CN disclosed