SCHEMBL21368249

SCHEMBL21368249

CN1CNc2cccc3cccc1c23

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 10/20 0.55
▸ MAPT P10636 10/20 0.55
▸ ALDH1A1 P00352 9/20 0.55
▸ GAA P10253 7/20 0.55
▸ HPGD P15428 6/20 0.55
▸ KMT2A Q03164 8/20 0.50
▸ MEN1 O00255 7/20 0.40
▸ NSD2 O96028 4/20 0.40
▸ HSD17B10 Q99714 4/20 0.40
▸ APP P05067 2/20 0.40
▸ SNCA P37840 2/20 0.40
▸ ALOX12 P18054 1/20 0.40
▸ RAD52 P43351 1/20 0.37
▸ APAF1 O14727 2/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ BRPF1 P55201 1/20 0.36
▸ HTT P42858 2/20 0.35
▸ CASP1 P29466 1/20 0.35
▸ CASP7 P55210 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
SCHEMBL30738818 0.78 BRPF1 (0.50) KDM4EMAPTALDH1A1GAAHPGD
SCHEMBL4013751 0.78 BRPF1 (0.50) KDM4EMAPTALDH1A1GAAHPGD
SCHEMBL8972507 0.75 KMT2A (0.41) KDM4EMAPTALDH1A1GAAHPGD
SCHEMBL23870613 0.74 KMT2A (0.39) KDM4EMAPTALDH1A1GAAHPGD
SCHEMBL6934957 0.74 KMT2A (0.39) KDM4EMAPTALDH1A1GAAHPGD
SCHEMBL8973254 0.72 KMT2A (0.38) KDM4EMAPTALDH1A1GAAHPGD
SCHEMBL8756210 0.71 KMT2A (0.43) KDM4EMAPTALDH1A1GAAHPGD
SCHEMBL9161190 0.71 ALDH1A1 (1.00) KDM4EMAPTALDH1A1GAAHPGD
SCHEMBL28489824 0.71 KMT2A (0.55) KDM4EMAPTALDH1A1GAAHPGD
SCHEMBL10604558 0.71 KMT2A (0.37) KDM4EMAPTALDH1A1GAAHPGD

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-2019177689-A1 CURABLE POLYSILOXANE COMPOSITION DOW SILICONES CORPORATION (US) 2019-09-19 — — WO disclosed
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