SCHEMBL9837594

SCHEMBL9837594

CC1NC(=O)NN=C1c1ccc(OCC(=O)NN)c(Cl)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 3/20 0.41
PDE3A Q14432 3/20 0.41
PDE4A P27815 1/20 0.41
PDE4B Q07343 1/20 0.41
PDE4C Q08493 1/20 0.41
PDE4D Q08499 1/20 0.41
SMN1; SMN2 Q16637 4/20 0.39
TSHR P16473 3/20 0.38
GPR119 Q8TDV5 1/20 0.38
KMT2A Q03164 3/20 0.37
HPGD P15428 3/20 0.37
MEN1 O00255 2/20 0.37
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
TP53 P04637 2/20 0.37
MAPT P10636 2/20 0.37
MAPK1 P28482 2/20 0.37
PKM P14618 1/20 0.37
OGG1 O15527 1/20 0.37
ALDH1A1 P00352 2/20 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
SCHEMBL9836932 0.89 TSHR (0.43) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL9836476 0.87 TDP1 (0.48) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL9834628 0.86 MAPT (0.43) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL9836049 0.85 MEN1 (0.50) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL9835522 0.84 HPGD (0.45) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL9834522 0.83 ALDH1A1 (0.42) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL9836412 0.83 ALDH1A1 (0.51) SMN1; SMN2HPGDRAB9ATP53MAPT
SCHEMBL9835976 0.83 SMN1; SMN2 (0.47) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10431228 0.81 ALDH1A1 (0.59) SMN1; SMN2TSHRKMT2AHPGDNPC1
SCHEMBL9835111 0.81 ALDH1A1 (0.53) SMN1; SMN2KMT2ATP53MAPTPKM

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-0238357-B1 1,2,4-TRIAZINONE DERIVATIVES, THEIR PREPARATION AND USE Sankyo Company Limited (JP) 1991-05-29 EP disclosed
US-4898862-A 1,2,4-triazinone derivatives, their preparation and use SANKYO COMPANY LIMITED (JP) 1990-02-06 US disclosed
EP-0238357-A2 1,2,4-Triazinone derivatives, their preparation and use Sankyo Company Limited (JP) 1987-09-23 EP disclosed