SCHEMBL28890372

SCHEMBL28890372

CCCCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCCCC)OC(=O)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
ALDH1A1 P00352 2/20 0.54
PNLIP P16233 3/20 0.49
CTSK P43235 1/20 0.49
CES2 O00748 2/20 0.49
CES1 P23141 2/20 0.49
LMNA P02545 3/20 0.49
PRSS1 P07477 3/20 0.48
CTSG P08311 2/20 0.48
CTRB1 P17538 2/20 0.48
CMA1 P23946 2/20 0.48
PRKCA P17252 1/20 0.48
PRKCD Q05655 1/20 0.48
PRSS2 P07478 1/20 0.48
PRSS3 P35030 1/20 0.48
NAAA Q02083 1/20 0.47
TSHR P16473 3/20 0.47
TP53 P04637 1/20 0.47
ALOX12 P18054 1/20 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
SCHEMBL16423824 1.00 MEN1 (0.54) MEN1KMT2AALDH1A1PNLIPCTSK
SCHEMBL28452193 1.00 MEN1 (0.54) MEN1KMT2AALDH1A1PNLIPCTSK
SCHEMBL298095 1.00 MEN1 (0.54) MEN1KMT2AALDH1A1PNLIPCTSK
SCHEMBL245922 1.00 MEN1 (0.54) MEN1KMT2AALDH1A1PNLIPCTSK
SCHEMBL1331116 1.00 MEN1 (0.54) MEN1KMT2AALDH1A1PNLIPCTSK
SCHEMBL1769317 1.00 MEN1 (0.54) MEN1KMT2AALDH1A1PNLIPCTSK
SCHEMBL29105830 0.98 MEN1 (0.53) MEN1KMT2AALDH1A1PNLIPCTSK
SCHEMBL297737 0.98 MEN1 (0.53) MEN1KMT2AALDH1A1PNLIPCTSK
SCHEMBL18979325 0.97 MEN1 (0.52) MEN1KMT2AALDH1A1PNLIPCTSK
SCHEMBL18979347 0.97 MEN1 (0.52) MEN1KMT2AALDH1A1PNLIPCTSK

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-111272304-A Lower critical temperature indicator 苏州和萃新材料有限公司 2020-06-12 CN disclosed