SCHEMBL22793930

SCHEMBL22793930

CCCCOCCNCc1ccc(N2CCN(C(C)C)CC2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 6/20 0.43
▸ ALDH1A1 P00352 3/20 0.43
▸ MAPT P10636 3/20 0.43
▸ PKM P14618 1/20 0.43
▸ HRH3 Q9Y5N1 7/20 0.40
▸ TDP1 Q9NUW8 2/20 0.39
▸ THRB P10828 1/20 0.39
▸ GAA P10253 2/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ HRH4 Q9H3N8 1/20 0.38
▸ LMNA P02545 2/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ L3MBTL1 Q9Y468 2/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ APP P05067 1/20 0.37
▸ ALOX15 P16050 1/20 0.37
▸ ALOX12 P18054 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ SNCA P37840 1/20 0.37
▸ KMT2A Q03164 1/20 0.37

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
SCHEMBL22793929 0.99 KDM4E (0.42) KDM4EALDH1A1MAPTPKMHRH3
SCHEMBL25109776 0.92 HRH3 (0.46) KDM4EALDH1A1MAPTPKMHRH3
SCHEMBL25111056 0.91 KDM4E (0.37) KDM4EALDH1A1MAPTHRH3TDP1
SCHEMBL25110291 0.89 KDM4E (0.37) KDM4EALDH1A1MAPTHRH3TDP1
SCHEMBL24513989 0.88 KDM4E (0.41) KDM4EALDH1A1MAPTPKMHRH3
SCHEMBL25110817 0.86 KDM4E (0.42) KDM4EALDH1A1MAPTHRH3TDP1
SCHEMBL25108926 0.85 NCF1 (0.48) KDM4EMAPTHRH3TDP1THRB
SCHEMBL25110212 0.85 KDM4E (0.42) KDM4EALDH1A1MAPTPKMHRH3
SCHEMBL22790759 0.85 KDM4E (0.42) KDM4EALDH1A1MAPTPKMHRH3
SCHEMBL24513990 0.84 KDM4E (0.41) KDM4EALDH1A1MAPTPKMHRH3

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
WO-2022125804-A1 SMARCA DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2022-06-16 — — WO disclosed
WO-2020251971-A1 SMARCA DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2020-12-17 — — WO disclosed
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