SCHEMBL9302799

SCHEMBL9302799

N=C(N)Nc1ccccc1C(=O)Nc1ccc2cccc(C(=N)N)c2c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 2/20 0.50
DEGS1 O15121 1/20 0.49
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
PLAU P00749 3/20 0.46
NPC1 O15118 4/20 0.46
RAB9A P51151 4/20 0.46
TMPRSS2 O15393 1/20 0.45
KDM4E B2RXH2 1/20 0.45
POLB P06746 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
KLK1 P06870 3/20 0.45
PTGES O14684 1/20 0.45
KLK5 Q9Y337 1/20 0.45
PLG P00747 4/20 0.44
F2 P00734 2/20 0.44
F10 P00742 2/20 0.44
PLAT P00750 2/20 0.44
NR1H4 Q96RI1 2/20 0.44
PPARG P37231 1/20 0.44

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
SCHEMBL9303292 0.91 RXFP1 (0.52) RXFP1DEGS1MEN1KMT2APLAU
SCHEMBL9303115 0.84 PLAU (0.53) MEN1KMT2APLAUNPC1RAB9A
SCHEMBL9303522 0.82 PLAU (0.61) RXFP1PLAUKLK1PLGF2
SCHEMBL9304321 0.82 PLAU (0.50) MEN1KMT2APLAUNPC1RAB9A
SCHEMBL9302832 0.82 RXFP1 (0.50) RXFP1DEGS1MEN1KMT2APLAU
SCHEMBL9303229 0.81 PLAU (0.56) RXFP1MEN1KMT2APLAUNPC1
SCHEMBL9303020 0.81 NR1H4 (0.53) RXFP1PLAUKLK1PTGESPLG
SCHEMBL9302787 0.81 PLAU (0.45) DEGS1MEN1KMT2APLAUNPC1
SCHEMBL9303445 0.80 NPC1 (0.54) RXFP1MEN1KMT2ANPC1RAB9A
SCHEMBL9303274 0.80 PLAU (0.62) PLAUNPC1RAB9AKDM4EPOLB

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5352704-A Antiviral agents BANYU PHARMACEUTICAL CO., LTD. (JP) 1994-10-04 US disclosed
EP-0434432-B1 Guanidinobenzene derivatives BANYU PHARMA CO LTD (JP) 1994-05-04 EP disclosed
EP-0434432-A1 Guanidinobenzene derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 1991-06-26 EP disclosed