SCHEMBL7345232

SCHEMBL7345232

O=C(O)c1cc2c([nH]c1=O)Cc1ncccc1-2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.46
ALDH1A1 P00352 3/20 0.46
HPGD P15428 3/20 0.46
HSD17B10 Q99714 3/20 0.46
TDP1 Q9NUW8 1/20 0.38
CYP3A4 P08684 1/20 0.37
MAPT P10636 1/20 0.37
ALOX15 P16050 1/20 0.37
TSHR P16473 1/20 0.37
BLM P54132 1/20 0.37
AGER Q15109 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
NAPRT Q6XQN6 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
LMNA P02545 1/20 0.36
GAA P10253 1/20 0.36
KDM5B Q9UGL1 2/20 0.34
KDM5A P29375 1/20 0.34
KDM4C Q9H3R0 1/20 0.34

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
SCHEMBL7348959 0.88 CSNK1A1 (0.39) KDM4EDDB1CRBN
SCHEMBL7340073 0.77 CSNK1A1 (0.39) KDM4EALDH1A1HPGDHSD17B10ALOX15
SCHEMBL7338731 0.77 PARP1 (0.40) HPGDMAPTSMN1; SMN2PPARG
SCHEMBL7340845 0.76 KDM4E (0.44) KDM4EALDH1A1HPGDHSD17B10CYP3A4
SCHEMBL7340881 0.71 KDM4E (0.54) KDM4EALDH1A1HPGDHSD17B10LMNA
SCHEMBL7346618 0.68 AURKA (0.36) KDM4EALDH1A1HPGDHSD17B10TDP1
SCHEMBL373592 0.68 DAO (0.64) KDM4EALDH1A1TDP1CYP3A4MAPT
SCHEMBL11072722 0.68 KDM4E (0.46) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL13482827 0.67 KDM4E (0.70) KDM4EALDH1A1HPGDHSD17B10ALOX15
SCHEMBL10991971 0.67 KDM4E (0.56) KDM4EALDH1A1HPGDHSD17B10TDP1

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
US-4511569-A Tricyclic lactams and derivatives useful in increasing cardiac contractility SCHERING CORPORATION (US) 1985-04-16 US disclosed
EP-0102046-A1 Tricyclic lactams, method for making them, pharmaceutical compositions containing them SCHERING CORPORATION (US) 1984-03-07 EP disclosed