SCHEMBL28703221

SCHEMBL28703221

CCCCCCc1ccc(-c2cccc3nsnc23)s1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ HIF1A Q16665 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ KCNH2 Q12809 1/20 0.36
▸ TSHR P16473 1/20 0.34
▸ TLR8 Q9NR97 1/20 0.33
▸ TLR7 Q9NYK1 1/20 0.33
▸ PTPN1 P18031 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.32
▸ KMT2A Q03164 1/20 0.32

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
SCHEMBL29236176 1.00 MAPT (0.36) MAPTKDM4EHIF1AHSD17B10KCNH2
SCHEMBL25182939 0.86 CYP3A4 (0.35) MAPTKDM4EHIF1AHSD17B10KCNH2
SCHEMBL20658858 0.86 CYP3A4 (0.35) MAPTKDM4EHIF1AHSD17B10KCNH2
SCHEMBL14702228 0.84 CYP1A2 (0.34) MAPTKDM4EKCNH2PTPN1ALDH1A1
SCHEMBL14699625 0.84 CYP1A2 (0.34) MAPTKDM4EKCNH2PTPN1ALDH1A1
SCHEMBL21406559 0.81 CYP1A2 (0.30) —
SCHEMBL16806601 0.80 DPP4 (0.39) MAPTKDM4EHSD17B10KCNH2ALDH1A1
SCHEMBL16806599 0.80 CYP1A2 (0.32) KDM4E
SCHEMBL17694551 0.80 CYP1A2 (0.32) KDM4E
SCHEMBL15165574 0.80 CYP1A2 (0.32) KDM4E

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
CN-108473864-B Nanoparticles for light emitting applications 克罗米顿有限公司 2022-03-01 — — CN disclosed
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