SCHEMBL31296579

SCHEMBL31296579

CCCCCCCCCCCCCCC(C)COC(=O)Cc1ccc(O)c(O)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 3/20 0.51
YWHAG P61981 1/20 0.50
HSD17B10 Q99714 2/20 0.43
MAPT P10636 2/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
IAPP P10997 1/20 0.43
KDM4E B2RXH2 1/20 0.41
RGS12 O14924 1/20 0.41
LMNA P02545 1/20 0.41
POLB P06746 1/20 0.41
GAA P10253 1/20 0.41
HPGD P15428 1/20 0.41
TSHR P16473 1/20 0.41
NFKB1 P19838 1/20 0.41
APEX1 P27695 1/20 0.41
THPO P40225 1/20 0.41
BLM P54132 1/20 0.41
GNAI1 P63096 1/20 0.41
PMP22 Q01453 1/20 0.41

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
SCHEMBL28664039 1.00 TRPV1 (0.51) TRPV1YWHAGHSD17B10MAPTMEN1
SCHEMBL28663943 1.00 TRPV1 (0.51) TRPV1YWHAGHSD17B10MAPTMEN1
SCHEMBL31296573 1.00 TRPV1 (0.51) TRPV1YWHAGHSD17B10MAPTMEN1
SCHEMBL22471844 1.00 TRPV1 (0.51) TRPV1YWHAGHSD17B10MAPTMEN1
SCHEMBL22471849 1.00 TRPV1 (0.51) TRPV1YWHAGHSD17B10MAPTMEN1
SCHEMBL22471819 0.87 ESR1 (0.45) TRPV1MAPT
SCHEMBL28669027 0.87 ESR1 (0.45) TRPV1MAPT
SCHEMBL22471871 0.87 ESR1 (0.45) TRPV1MAPT
SCHEMBL22471804 0.87 ESR1 (0.45) TRPV1MAPT
SCHEMBL31296584 0.86 PRSS1 (0.53) TRPV1YWHAGHSD17B10MAPTMEN1

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-113767159-B Reversible thermochromic microcapsule pigment 百乐墨水株式会社 2024-12-06 CN disclosed