SCHEMBL8304800

SCHEMBL8304800

CSc1ncn(C)c1C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APOBEC3A P31941 4/20 0.39
APOBEC3G Q9HC16 3/20 0.39
L3MBTL1 Q9Y468 1/20 0.35
BCAT2 O15382 1/20 0.34
LMNA P02545 1/20 0.34
HPGD P15428 1/20 0.34
CTDSP1 Q9GZU7 2/20 0.34
CYP2C19 P33261 1/20 0.33
MAPT P10636 2/20 0.33
KDM2B Q8NHM5 1/20 0.33
KDM4C Q9H3R0 1/20 0.33
NR4A1 P22736 1/20 0.32
NR4A2 P43354 1/20 0.32
KMT2A Q03164 3/20 0.32
KDM6B O15054 1/20 0.32
KDM4A O75164 1/20 0.32
KDM4D Q6B0I6 1/20 0.32
HIF1AN Q9NWT6 1/20 0.32
KDM2A Q9Y2K7 1/20 0.32
MEN1 O00255 1/20 0.32

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
SCHEMBL926257 0.83 APOBEC3A (0.38) APOBEC3AAPOBEC3GLMNACTDSP1KMT2A
SCHEMBL67836 0.74 APOBEC3A (0.50) APOBEC3AAPOBEC3GL3MBTL1BCAT2LMNA
SCHEMBL3054669 0.74 APOBEC3A (0.42) APOBEC3AAPOBEC3GBCAT2LMNAHPGD
SCHEMBL21879818 0.74 APOBEC3A (0.42) APOBEC3AAPOBEC3GBCAT2LMNAHPGD
SCHEMBL23716719 0.72 APOBEC3A (0.41) APOBEC3AAPOBEC3GBCAT2LMNAHPGD
SCHEMBL21880074 0.72 APOBEC3A (0.41) APOBEC3AAPOBEC3GL3MBTL1BCAT2LMNA
SCHEMBL14710278 0.72 APOBEC3A (0.41) APOBEC3AAPOBEC3GL3MBTL1BCAT2LMNA
Methylamine SCHEMBL5149607 0.71 APOBEC3A (0.47) APOBEC3AAPOBEC3GBCAT2LMNAHPGD
SCHEMBL10711618 0.70 KDM4E (0.56) LMNAHPGDCYP2C19MAPTKMT2A
SCHEMBL31332957 0.69 APOBEC3A (0.39) APOBEC3AAPOBEC3GBCAT2LMNAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0695748-B1 Tetrazolinone herbicides BAYER AGROCHEM KK (JP) 1999-05-06 EP disclosed
US-5811445-A ANGIOTENSIN II INHIBITORS ROUSSEL UCLAF (FR) 1998-09-22 US disclosed
US-5589439-A HERBICIDES NIHON BAYER AGROCHEM K.K. (JP) 1996-12-31 US disclosed
EP-0695748-A1 Tetrazolinone herbicides NIHON BAYER AGROCHEM K.K. (JP) 1996-02-07 EP disclosed