SCHEMBL17754333

SCHEMBL17754333

C=CC(=O)COc1ccc(OC(=O)c2ccc(OC)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.52
KMT2A Q03164 4/20 0.52
GFER P55789 1/20 0.52
LMNA P02545 3/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
CYP1A2 P05177 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
PRSS1 P07477 1/20 0.49
ACR P10323 1/20 0.49
GAA P10253 3/20 0.49
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
NPC1 O15118 1/20 0.45
POLB P06746 1/20 0.45
RAB9A P51151 1/20 0.45
BLM P54132 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
PKM P14618 1/20 0.44
KDM4E B2RXH2 1/20 0.44

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
SCHEMBL17754291 1.00 MAPT (0.52) MAPTKMT2AGFERLMNASMN1; SMN2
SCHEMBL17754290 1.00 MAPT (0.52) MAPTKMT2AGFERLMNASMN1; SMN2
SCHEMBL17754318 0.96 KMT2A (0.49) MAPTKMT2AGFERLMNASMN1; SMN2
SCHEMBL17754329 0.96 KMT2A (0.49) MAPTKMT2AGFERLMNASMN1; SMN2
SCHEMBL17754299 0.93 KMT2A (0.46) MAPTKMT2AGFERLMNASMN1; SMN2
SCHEMBL17754303 0.88 KMT2A (0.43) MAPTKMT2ALMNASMN1; SMN2CYP1A2
SCHEMBL17754289 0.83 MAPT (0.47) MAPTKMT2ALMNACYP1A2PRSS1
SCHEMBL17364494 0.83 KMT2A (0.52) MAPTKMT2AGFERLMNASMN1; SMN2
SCHEMBL8966828 0.83 LMNA (0.50) MAPTKMT2AGFERLMNASMN1; SMN2
SCHEMBL7776960 0.82 MAPT (0.55) MAPTKMT2AGFERLMNASMN1; SMN2

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
US-20160137921-A1 POLYMERIZABLE COMPOUND, AND LIQUID CRYSTAL COMPOSITION PRODUCED USING SAME DIC CORPORATION (JP) 2016-05-19 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160137921-A1 POLYMERIZABLE COMPOUND, AND LIQUID CRYSTAL COMPOSITION PRODUCED USING SAME RCC1, LPXN, SMC4 MAPT 66/4885KMT2A 2308/4885GFER 3187/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.