SCHEMBL7004254

SCHEMBL7004254

Cn1ccn2c(cc3ccccc32)c1=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DAO P14920 1/20 0.46
HSD17B10 Q99714 4/20 0.43
KMT2A Q03164 3/20 0.43
HPGD P15428 2/20 0.43
MAPT P10636 2/20 0.43
ALDH1A1 P00352 2/20 0.43
MEN1 O00255 1/20 0.43
HTT P42858 1/20 0.43
LMNA P02545 3/20 0.40
TSHR P16473 2/20 0.40
TP53 P04637 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
BRD4 O60885 2/20 0.39
BRPF1 P55201 2/20 0.39
BRD9 Q9H8M2 2/20 0.39
CA12 O43570 1/20 0.39
CA9 Q16790 1/20 0.39
KAT2B Q92831 1/20 0.39
NOTUM Q6P988 2/20 0.39
MCL1 Q07820 1/20 0.39

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
SCHEMBL7005436 0.79 MAPT (0.38) DAOHSD17B10KMT2AHPGDMAPT
SCHEMBL7006296 0.78 TP53 (0.38) KMT2AMAPTMEN1HTTTP53
SCHEMBL7006177 0.78 DAO (0.36) DAOKMT2AALDH1A1MEN1SMN1; SMN2
SCHEMBL7006877 0.78 HTR3E (0.37) DAOHSD17B10KMT2AHPGDALDH1A1
SCHEMBL7002931 0.76 KDM4E (0.46) HSD17B10HPGDALDH1A1LMNATP53
SCHEMBL7003133 0.76 CA2 (0.44) KMT2AALDH1A1MEN1MAPK1
SCHEMBL7002892 0.76 HTR2C (0.54) HSD17B10KMT2AHPGDMAPTALDH1A1
SCHEMBL7004576 0.75 SLC9A1 (0.38) KMT2AHPGDMAPTALDH1A1MEN1
SCHEMBL7009955 0.74 NPC1 (0.56) KMT2AMEN1CREBBP
SCHEMBL7006729 0.74 ALOX5 (0.48) KMT2AMEN1CA12CA9CREBBP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1200439-B1 1,2-DIHYDRO-1-OXO-PARAZINO(1,2-A) INDOLE DERIVATIVES NOVUSPHARMA SPA (IT) 2003-06-25 EP disclosed