SCHEMBL8307098

SCHEMBL8307098

Cc1ccc(-c2ccnc(-c3ncccc3C(=O)O)n2)cc1Cl

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMO O15229 12/20 0.62
KDM4E B2RXH2 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
TP53 P04637 2/20 0.45
MAPT P10636 2/20 0.45
MEN1 O00255 1/20 0.45
NPC1 O15118 1/20 0.45
PKM P14618 1/20 0.45
TSHR P16473 1/20 0.45
RAB9A P51151 1/20 0.45
KMT2A Q03164 1/20 0.45
EIF4E P06730 1/20 0.43
SMO Q99835 2/20 0.42
CLCN2 P51788 1/20 0.42

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
SCHEMBL8308388 0.82 KMO (0.62) KMOKDM4ETDP1NPC1RAB9A
SCHEMBL8305333 0.80 KDM4E (0.59) KDM4ETDP1MAPTTSHRSMO
SCHEMBL8304580 0.78 KDM4E (0.53) KMOKDM4ETDP1MAPTMEN1
SCHEMBL15569110 0.75 KDM4E (0.53) KMOKDM4ETDP1TP53MAPT
SCHEMBL25780881 0.72 KDM4E (0.80) KDM4ETDP1MAPTNPC1TSHR
SCHEMBL23354547 0.71 FTO (0.53) KMOKDM4ETSHREIF4E
SCHEMBL15569130 0.71 KDM4E (0.62) KDM4ETDP1TP53MAPTMEN1
SCHEMBL15567980 0.69 KDM4E (0.54) KMOKDM4ETDP1MAPTMEN1
SCHEMBL17201766 0.69 KDM4E (0.58) KMOKDM4ETDP1MAPTMEN1
SCHEMBL22641581 0.69 KMO (0.73) KMOKDM4ETP53MAPTMEN1

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-0739341-B1 HERBICIDAL ARYL AND HETEROARYL PYRIMIDINES NOVARTIS AG (CH) 1999-06-02 EP disclosed
EP-0739341-A1 HERBICIDAL ARYL AND HETEROARYL PYRIMIDINES Novartis AG (CH) 1996-10-30 EP disclosed
WO-1995019358-A1 HERBICIDAL ARYL AND HETEROARYL PYRIMIDINES SANDOZ LTD. (CH) 1995-07-20 WO disclosed