SCHEMBL10429322

SCHEMBL10429322

O=c1[nH]nnc2c(-c3ccc(Cl)cc3)nsc12

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.37
MAPT P10636 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
NOTUM Q6P988 2/20 0.36
KDM4E B2RXH2 2/20 0.35
RAB9A P51151 2/20 0.35
NPC1 O15118 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.33
RPA1 P27694 1/20 0.33
ALPL P05186 2/20 0.32
PDE3B Q13370 1/20 0.32
PDE3A Q14432 1/20 0.32
GRM5 P41594 1/20 0.32
GRM1 Q13255 1/20 0.32
LMNA P02545 2/20 0.32
HPGD P15428 1/20 0.31
CA12 O43570 1/20 0.31

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
SCHEMBL10429350 0.85 KDR (0.36) ALDH1A1ALPLPDE3BPDE3AHPGD
SCHEMBL2121780 0.85 NPSR1 (0.40) ALDH1A1SMN1; SMN2MEN1KMT2AKDM4E
Hydrochloric Acid SCHEMBL10429329 0.84 KDR (0.35) ALDH1A1ALPLPDE3BPDE3AHPGD
SCHEMBL10429313 0.83 NOTUM (0.38) ALDH1A1MAPTSMN1; SMN2KMT2ATDP1
SCHEMBL10429367 0.82 HPGD (0.47) ALDH1A1MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL10429337 0.81 XDH (0.40) ALDH1A1MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL10429302 0.80 HPGD (0.36) ALDH1A1MAPTMEN1KMT2ATDP1
SCHEMBL7162696 0.79 PDE4A (0.38) ALDH1A1MAPTMEN1KMT2ALMNA
SCHEMBL10429340 0.78 NOTUM (0.39) ALDH1A1MAPTSMN1; SMN2NOTUMKDM4E
SCHEMBL10429304 0.78 SMN1; SMN2 (0.43) ALDH1A1MAPTSMN1; SMN2MEN1KMT2A

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
EP-0274654-A2 1,2,3-Triazin-4(3H)-one derivatives, process for their preparation and medicaments containing them F. HOFFMANN-LA ROCHE AG (CH) 1988-07-20 EP claimed
US-4920119-A XANTHINE OXIDASE INHIBITORS; CONTROL OR PREVENTION OF GOUT OR ISCHEMIA HOFFMANN-LA ROCHE INC. (US) 1990-04-24 US disclosed
EP-0274654-A2 1,2,3-Triazin-4(3H)-one derivatives, process for their preparation and medicaments containing them F. HOFFMANN-LA ROCHE AG (CH) 1988-07-20 EP disclosed