SCHEMBL25544880

SCHEMBL25544880

C=C(/N=C(\N)c1ccccc1)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.50
▸ MEN1 O00255 1/20 0.50
▸ GAA P10253 2/20 0.48
▸ NPC1 O15118 1/20 0.48
▸ RAB9A P51151 1/20 0.48
▸ POLB P06746 2/20 0.47
▸ GRIN2B Q13224 3/20 0.45
▸ GRIN1 Q05586 2/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.41
▸ BLM P54132 2/20 0.41
▸ RECQL P46063 2/20 0.41
▸ CYP2C19 P33261 2/20 0.41
▸ F2 P00734 1/20 0.41
▸ F10 P00742 1/20 0.41
▸ F12 P00748 1/20 0.41
▸ F7 P08709 1/20 0.41
▸ F3 P13726 1/20 0.41
▸ PKM P14618 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ PARP1 P09874 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
SCHEMBL23284392 0.86 NPC1 (0.46) KMT2AMEN1GAANPC1RAB9A
SCHEMBL18678662 0.78 PRSS1 (0.44) KMT2AMEN1GAANPC1RAB9A
SCHEMBL13241449 0.78 GRIN2B (0.46) KMT2AMEN1GAANPC1RAB9A
SCHEMBL14235670 0.77 BLM (0.40) KMT2AMEN1GAAPOLBBLM
SCHEMBL22172426 0.75 ATM (0.44) KMT2AMEN1POLBGRIN2BGRIN1
SCHEMBL13920671 0.75 MEN1 (0.44) KMT2AMEN1GAANPC1RAB9A
SCHEMBL12920098 0.75 BLM (0.39) KMT2AMEN1GAANPC1RAB9A
SCHEMBL21871024 0.75 NPC1 (0.40) KMT2AMEN1GAANPC1RAB9A
SCHEMBL15599673 0.74 MAPT (0.54) KMT2AMEN1GAANPC1RAB9A
SCHEMBL17504830 0.74 MAPT (0.54) KMT2AMEN1GAANPC1RAB9A

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
EP-4207992-A1 ORGANIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE INCLUDING THE SAME LG Display Co., Ltd. (KR) 2023-07-05 — — EP disclosed
EP-3239136-B1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME SOLUS ADVANCED MATERIALS CO LTD (KR) 2023-06-07 — — EP disclosed
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