SCHEMBL22471807

SCHEMBL22471807

CCCCCCCCCCCCCCCCCCC(=O)Oc1ccc(O)c(O)c1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.53
▸ SMN1; SMN2 Q16637 1/20 0.53
▸ CA2 P00918 3/20 0.53
▸ APP P05067 1/20 0.51
▸ TRPV1 Q8NER1 2/20 0.50
▸ HTR1A P08908 1/20 0.49
▸ HTR1B P28222 1/20 0.49
▸ MEN1 O00255 2/20 0.48
▸ NPC1 O15118 1/20 0.48
▸ RAB9A P51151 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ TDP1 Q9NUW8 1/20 0.48
▸ HSD17B10 Q99714 1/20 0.48
▸ MAPT P10636 1/20 0.48
▸ CNR2 P34972 2/20 0.47

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
SCHEMBL22471831 1.00 KMT2A (0.53) KMT2ASMN1; SMN2CA2APPTRPV1
SCHEMBL22471860 1.00 KMT2A (0.53) KMT2ASMN1; SMN2CA2APPTRPV1
SCHEMBL28658540 1.00 KMT2A (0.53) KMT2ASMN1; SMN2CA2APPTRPV1
SCHEMBL28929748 1.00 KMT2A (0.53) KMT2ASMN1; SMN2CA2APPTRPV1
SCHEMBL28663944 1.00 KMT2A (0.53) KMT2ASMN1; SMN2CA2APPTRPV1
SCHEMBL28655064 1.00 KMT2A (0.53) KMT2ASMN1; SMN2CA2APPTRPV1
SCHEMBL9237069 0.90 KMT2A (0.53) KMT2ASMN1; SMN2CA2APPALDH1A1
SCHEMBL11758944 0.88 KMT2A (0.51) KMT2ASMN1; SMN2CA2TRPV1HTR1A
SCHEMBL23499206 0.87 BCL9 (0.53) KMT2ACA2RAB9AALDH1A1TDP1
SCHEMBL12919756 0.87 HTT (0.52) KMT2ASMN1; SMN2CA2HTR1AHTR1B

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
CN-113767159-A Reversible thermochromic microcapsule pigments 百乐墨水株式会社 2021-12-07 — — CN disclosed
WO-2020196073-A1 REVERSIBLE THERMOCHROMIC MICROCAPSULE PIGMENT パイロットインキ株式会社 2020-10-01 — — WO disclosed
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