SCHEMBL24054474

SCHEMBL24054474

Clc1nc(-c2ccccc2)nc2c1CCC=C2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.46
▸ MEN1 O00255 3/20 0.46
▸ HTT P42858 2/20 0.46
▸ LMNA P02545 4/20 0.42
▸ ADORA2A P29274 2/20 0.34
▸ ADORA1 P30542 2/20 0.34
▸ POLB P06746 1/20 0.34
▸ ADORA3 P0DMS8 1/20 0.34
▸ ADORA2B P29275 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ DHPS P49366 1/20 0.33
▸ HPGD P15428 2/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ PKM P14618 1/20 0.32
▸ NPC1 O15118 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ ACP1 P24666 1/20 0.31
▸ ATP4A P20648 1/20 0.31

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
SCHEMBL18698090 0.83 HTR2A (0.41) KMT2AMEN1ADORA2AADORA1POLB
SCHEMBL24279824 0.74 KDM4E (0.35) KMT2AMEN1LMNAPOLBL3MBTL1
SCHEMBL2273843 0.69 LMNA (0.52) KMT2AMEN1HTTLMNAADORA2A
SCHEMBL2624086 0.69 LMNA (0.56) KMT2AMEN1HTTLMNAPOLB
SCHEMBL21861288 0.68 CETP (0.34) KMT2AMEN1HTTLMNAL3MBTL1
SCHEMBL376122 0.67 LMNA (0.73) KMT2AMEN1HTTLMNAADORA2A
SCHEMBL16824569 0.67 TNKS (0.46) KMT2AMEN1POLBADORA2BL3MBTL1
SCHEMBL13779458 0.67 KMT2A (0.47) KMT2AMEN1HTTLMNAADORA2A
SCHEMBL3427195 0.66 MEN1 (0.65) KMT2AMEN1HTTLMNAADORA2A
SCHEMBL21636291 0.65 MEN1 (0.35) KMT2AMEN1HTTADORA2AADORA1

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-3604298-B1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME LT MATERIALS CO LTD (KR) 2022-03-30 — — EP disclosed
WO-2021235820-A1 ORGANIC LIGHT-EMITTING DEVICE 엘티소재주식회사 2021-11-25 — — WO disclosed
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