SCHEMBL30133223

SCHEMBL30133223

c1ccc2c(c1)N=C1Nc3ccccc3N=C1N2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 9/20 0.50
MAPT P10636 8/20 0.50
MEN1 O00255 8/20 0.50
LMNA P02545 6/20 0.50
GAA P10253 6/20 0.50
KDM4E B2RXH2 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.47
ALDH1A1 P00352 4/20 0.44
ESR1 P03372 1/20 0.42
MCL1 Q07820 2/20 0.42
RAB9A P51151 2/20 0.42
USP2 O75604 1/20 0.42
ALOX12 P18054 1/20 0.42
NOX1 Q9Y5S8 1/20 0.41
PKM P14618 1/20 0.41
TP53 P04637 2/20 0.40
NPC1 O15118 1/20 0.40
CASP3 P42574 1/20 0.40
SENP8 Q96LD8 1/20 0.40
SENP7 Q9BQF6 1/20 0.40

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
SCHEMBL14254473 0.77 NOX1 (0.45) KMT2AMAPTMEN1LMNAGAA
SCHEMBL15018298 0.75 KMT2A (0.77) KMT2AMAPTMEN1LMNAGAA
SCHEMBL824454 0.73 LMNA (0.43) KMT2AMAPTMEN1LMNAGAA
SCHEMBL240371 0.72 MAPT (0.43) KMT2AMAPTMEN1LMNAGAA
SCHEMBL13819803 0.72 MAPT (0.43) KMT2AMAPTMEN1LMNAGAA
SCHEMBL4573048 0.72 LMNA (0.42) KMT2AMAPTMEN1LMNAGAA
SCHEMBL10959987 0.72 LMNA (0.46) KMT2AMAPTMEN1LMNAGAA
SCHEMBL2140019 0.71 MAPT (0.45) KMT2AMAPTMEN1LMNAGAA
SCHEMBL12195999 0.69 DRD2 (0.48) KMT2AMAPTMEN1LMNAGAA
SCHEMBL8718926 0.69 GAA (0.62) KMT2AMAPTMEN1LMNAGAA

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-12051807-B2 Electrode material WASEDA UNIVERSITY (JP) 2024-07-30 US disclosed
US-20230026457-A1 ELECTRODE MATERIAL WASEDA UNIVERSITY (JP) 2023-01-26 US disclosed