SCHEMBL7003435

SCHEMBL7003435

O=C(O)NC(=O)c1ccc(Cl)nn1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
JUN P05412 1/20 0.50
NFKB1 P19838 1/20 0.50
NFKB2 Q00653 1/20 0.50
RELA Q04206 1/20 0.50
POLB P06746 1/20 0.39
ALDH1A1 P00352 3/20 0.35
GAA P10253 2/20 0.35
MAPT P10636 1/20 0.35
LMNA P02545 2/20 0.35
HTT P42858 1/20 0.35
KCNQ3 O43525 1/20 0.33
KCNQ2 O43526 1/20 0.33
NAPRT Q6XQN6 1/20 0.33
KMT2A Q03164 3/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
RAB9A P51151 2/20 0.32
MEN1 O00255 1/20 0.32
GRM5 P41594 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
SCHEMBL8600253 0.78 P2RX7 (0.52) JUNNFKB1NFKB2RELAPOLB
SCHEMBL31306809 0.78 P2RX7 (0.52) JUNNFKB1NFKB2RELAPOLB
SCHEMBL667384 0.78 NFKB1 (0.51) JUNNFKB1NFKB2RELAPOLB
SCHEMBL380569 0.77 JUN (0.45) JUNNFKB1NFKB2RELAPOLB
SCHEMBL6418676 0.74 JUN (0.51) JUNNFKB1NFKB2RELAPOLB
SCHEMBL4155438 0.74 JUN (0.48) JUNNFKB1NFKB2RELAPOLB
SCHEMBL30553734 0.74 JUN (0.59) JUNNFKB1NFKB2RELAPOLB
SCHEMBL6983154 0.74 JUN (0.48) JUNNFKB1NFKB2RELAPOLB
SCHEMBL29988880 0.74 NFKB1 (0.48) JUNNFKB1NFKB2RELAPOLB
SCHEMBL20152022 0.74 JUN (0.48) JUNNFKB1NFKB2RELAPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1268443-A1 2-HYDROXY-MUTILIN CARBAMATE DERIVATIVES FOR ANTIBACTERIAL USE SmithKline Beecham p.l.c. (GB) 2003-01-02 EP disclosed
WO-2001074788-A1 2-HYDROXY-MUTILIN CARBAMATE DERIVATIVES FOR ANTIBACTERIAL USE SMITHKLINE BEECHAM PLC (GB) 2001-10-11 WO disclosed