SCHEMBL17898392

SCHEMBL17898392

CNc1ccc(-c2nc(-c3ccccc3)cc(-c3ccccc3)n2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 12/20 0.64
KMT2A Q03164 12/20 0.64
MAPT P10636 10/20 0.64
ALDH1A1 P00352 9/20 0.64
HPGD P15428 9/20 0.64
KDM4E B2RXH2 6/20 0.64
RXFP1 Q9HBX9 2/20 0.64
NPSR1 Q6W5P4 1/20 0.64
CYP2C19 P33261 1/20 0.64
TDP1 Q9NUW8 2/20 0.61
NTSR1 P30989 1/20 0.59
ADORA2A P29274 3/20 0.52
ADORA1 P30542 3/20 0.52
LMNA P02545 2/20 0.51
GLA P06280 1/20 0.51
ADORA3 P0DMS8 1/20 0.49
ABCG2 Q9UNQ0 1/20 0.48
AGTR1 P30556 2/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
TSHR P16473 1/20 0.47

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
SCHEMBL14123141 0.85 MEN1 (0.50) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL14122817 0.85 MEN1 (0.52) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL17367816 0.84 MEN1 (0.79) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL17970040 0.84 MEN1 (0.79) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL17367827 0.84 MEN1 (0.79) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL20160929 0.84 TDP1 (0.59) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL16285507 0.84 TDP1 (0.55) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL14123056 0.82 MEN1 (0.50) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL16285549 0.82 L3MBTL1 (0.46) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL10051312 0.82 MEN1 (0.76) MEN1KMT2AMAPTALDH1A1HPGD

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
US-20160197286-A1 ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2016-07-07 US disclosed