SCHEMBL8154709

SCHEMBL8154709

O=C(NCc1ccccc1)c1cccnc1C(=O)O

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.80
NSD2 O96028 1/20 0.66
KDM4E B2RXH2 3/20 0.65
MAPK8 P45983 1/20 0.63
ATM Q13315 1/20 0.63
USP2 O75604 1/20 0.59
APEX1 P27695 1/20 0.59
EGLN1 Q9GZT9 1/20 0.59
L3MBTL1 Q9Y468 2/20 0.57
ALDH1A1 P00352 1/20 0.57
CYP3A4 P08684 1/20 0.57
MAPT P10636 1/20 0.57
ALOX15 P16050 1/20 0.57
TSHR P16473 1/20 0.57
BLM P54132 1/20 0.57
AGER Q15109 1/20 0.57
NPSR1 Q6W5P4 1/20 0.57
ASPH Q12797 1/20 0.57
KDM8 Q8N371 1/20 0.57
ADORA2A P29274 1/20 0.56

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
SCHEMBL3556910 0.88 KMT2A (0.64) KMT2ANSD2KDM4EMAPK8ATM
SCHEMBL3715714 0.88 KMT2A (0.64) KMT2ANSD2KDM4EMAPK8ATM
SCHEMBL3182140 0.83 NSD2 (0.68) KMT2ANSD2KDM4EMAPK8ATM
SCHEMBL28747434 0.83 KMT2A (0.67) KMT2ANSD2KDM4EAPEX1L3MBTL1
SCHEMBL1724926 0.82 NSD2 (0.59) KMT2ANSD2KDM4EMAPK8ATM
SCHEMBL12142857 0.82 NSD2 (0.66) KMT2ANSD2KDM4EMAPK8ATM
SCHEMBL920392 0.82 NSD2 (0.66) KMT2ANSD2MAPK8ATMUSP2
SCHEMBL922492 0.82 NSD2 (0.66) KMT2ANSD2MAPK8ATMUSP2
SCHEMBL31569526 0.82 NSD2 (0.66) KMT2ANSD2KDM4EMAPK8ATM
SCHEMBL13139170 0.82 ATM (0.67) KMT2ANSD2KDM4EMAPK8ATM

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
JP-2000344769-A PRODUCTION OF N-BENZYLQUINOLINIC ACID IMIDE TAMA KAGAKU KOGYO KK 2000-12-12 JP disclosed
US-5118677-A For treating transplant rejection, host vs. draft disease, autoimmune diseases and inflammations; antibody inhibitors AMERICAN HOME PRODUCTS CORPORATION (US) 1992-06-02 US disclosed