SCHEMBL18931297

SCHEMBL18931297

Clc1cccc(C2N=C(c3ccccc3)N=C(c3ccccc3)N2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.41
▸ TP53 P04637 2/20 0.41
▸ MAOA P21397 1/20 0.41
▸ MAOB P27338 1/20 0.41
▸ RPS6KA3 P51812 1/20 0.39
▸ GRIN2B Q13224 2/20 0.39
▸ P2RX7 Q99572 3/20 0.38
▸ GAA P10253 2/20 0.36
▸ KMT2A Q03164 2/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ MCL1 Q07820 1/20 0.35
▸ SLC6A3 Q01959 1/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ NFKB1 P19838 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ NFKB2 Q00653 1/20 0.35
▸ RELA Q04206 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ SCN2A Q99250 1/20 0.35

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
SCHEMBL19452813 0.97 MAPT (0.43) MAPTTP53MAOAMAOBRPS6KA3
SCHEMBL19688406 0.95 TP53 (0.40) MAPTTP53MAOAMAOBRPS6KA3
SCHEMBL19007150 0.93 TP53 (0.39) MAPTTP53MAOAMAOBRPS6KA3
SCHEMBL16716646 0.92 TP53 (0.39) MAPTTP53MAOAMAOBRPS6KA3
SCHEMBL15683886 0.92 TP53 (0.39) MAPTTP53MAOAMAOBRPS6KA3
SCHEMBL24570004 0.91 TP53 (0.42) MAPTTP53MAOAMAOBRPS6KA3
SCHEMBL19688637 0.91 TP53 (0.42) MAPTTP53MAOAMAOBRPS6KA3
SCHEMBL18931292 0.89 TP53 (0.38) MAPTTP53MAOAMAOBRPS6KA3
SCHEMBL24570791 0.88 MAPT (0.39) MAPTTP53MAOAMAOBRPS6KA3
SCHEMBL19688122 0.87 TP53 (0.39) MAPTTP53MAOAMAOBRPS6KA3

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
WO-2017095084-A1 ORGANIC LIGHT-EMITTING COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME 주식회사 두산 2017-06-08 — — WO disclosed
Send feedback