SCHEMBL8307255

SCHEMBL8307255

CCN(C(=O)n1nnn(-c2cc(C)n(Cc3ccccc3)c2C)c1=O)C(C)C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.43
TSHR P16473 3/20 0.42
ALDH1A1 P00352 3/20 0.39
LMNA P02545 2/20 0.39
KDM4E B2RXH2 2/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
S1PR2 O95136 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
TDP2 O95551 1/20 0.37
NSD2 O96028 1/20 0.37
PLCG1 P19174 1/20 0.37
PAX8 Q06710 1/20 0.37
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
GRIA2 P42262 1/20 0.35
KLKB1 P03952 1/20 0.35
TP53 P04637 1/20 0.35
POLB P06746 1/20 0.35
MAPK1 P28482 1/20 0.35

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
SCHEMBL8306338 0.89 NOTUM (0.45) NOTUMTSHRALDH1A1LMNAKDM4E
SCHEMBL8307903 0.87 NOTUM (0.48) NOTUMTSHRALDH1A1LMNAKDM4E
SCHEMBL8302567 0.81 L3MBTL1 (0.43) NOTUMTSHRALDH1A1NPC1RAB9A
SCHEMBL9283536 0.78 POLB (0.45) ALDH1A1LMNAKDM4ENPC1KMT2A
SCHEMBL8308330 0.75 LMNA (0.39) ALDH1A1LMNANPC1RAB9ASMN1; SMN2
SCHEMBL8464528 0.70 KMT2A (0.39) TSHRALDH1A1LMNAKMT2AMAPK1
SCHEMBL8923227 0.70 HCAR1 (0.33) TSHRLMNA
SCHEMBL8923229 0.70 HCAR1 (0.33) TSHRLMNA
SCHEMBL8464531 0.70 KMT2A (0.39) TSHRALDH1A1LMNAKMT2AMAPK1
SCHEMBL8308641 0.68 NOTUM (0.47) NOTUMTSHRALDH1A1LMNAKDM4E

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-0695748-B1 Tetrazolinone herbicides BAYER AGROCHEM KK (JP) 1999-05-06 EP 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