SCHEMBL16406201

SCHEMBL16406201

[2H]c1ccnc2c1oc1ccccc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.51
MEN1 O00255 3/20 0.51
NPC1 O15118 4/20 0.44
LMNA P02545 4/20 0.44
RAB9A P51151 3/20 0.44
HTT P42858 2/20 0.44
USP2 O75604 1/20 0.44
ALDH1A1 P00352 8/20 0.42
KDM4E B2RXH2 5/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
MAPT P10636 5/20 0.41
LIMK1 P53667 1/20 0.41
HPGD P15428 4/20 0.41
HSD17B10 Q99714 2/20 0.41
GLA P06280 1/20 0.41
CYP3A4 P08684 1/20 0.41
PGAM1 P18669 1/20 0.41
MAOA P21397 1/20 0.41
CASP1 P29466 1/20 0.41
CASP7 P55210 1/20 0.41

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
SCHEMBL148991 0.84 KMT2A (0.58) KMT2AMEN1NPC1LMNARAB9A
SCHEMBL29625837 0.84 KMT2A (0.58) KMT2AMEN1NPC1LMNARAB9A
SCHEMBL27174137 0.84 KMT2A (0.58) KMT2AMEN1NPC1LMNARAB9A
Triphenylene SCHEMBL29177920 0.82 KMT2A (0.56) KMT2AMEN1NPC1LMNARAB9A
SCHEMBL20005635 0.78 KMT2A (0.50) KMT2AMEN1NPC1LMNARAB9A
SCHEMBL31036785 0.77 MEN1 (0.46) KMT2AMEN1NPC1LMNARAB9A
Pyridine SCHEMBL15673026 0.76 KMT2A (0.50) KMT2AMEN1NPC1LMNARAB9A
Dibenzothiophene SCHEMBL28528093 0.74 KMT2A (0.47) KMT2AMEN1NPC1LMNARAB9A
Dibenzofuran SCHEMBL29374562 0.73 MAPT (0.52) KMT2AMEN1NPC1RAB9AALDH1A1
SCHEMBL16406206 0.73 SMN1; SMN2 (0.49) KMT2AMEN1NPC1LMNARAB9A

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-9324949-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2016-04-26 US disclosed
US-20150021555-A1 DONOR-ACCEPTOR COMPOUNDS WITH NITROGEN CONTAINING HETEROPOLYAROMATICS AS THE ELECTRON ACCEPTOR UNIVERSAL DISPLAY CORPORATION 2015-01-22 US disclosed