SCHEMBL6523089

SCHEMBL6523089

CC/C(C(=O)O)=C(/CC(=O)c1ccc(C)cc1)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.59
RAB9A P51151 4/20 0.59
KMT2A Q03164 4/20 0.59
MEN1 O00255 3/20 0.59
MAPT P10636 3/20 0.50
GSK3B P49841 1/20 0.48
ALDH1A1 P00352 3/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
HSD11B1 P28845 1/20 0.42
GAA P10253 1/20 0.42
LMNA P02545 3/20 0.42
POLB P06746 1/20 0.42
CES2 O00748 2/20 0.42
CES1 P23141 2/20 0.42
KDM4E B2RXH2 1/20 0.42
PLA2G1B P04054 1/20 0.42
HPGD P15428 1/20 0.42
XBP1 P17861 1/20 0.42
ALOX12 P18054 1/20 0.42
HTT P42858 1/20 0.42

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
SCHEMBL6523093 1.00 NPC1 (0.59) NPC1RAB9AKMT2AMEN1MAPT
SCHEMBL6517563 0.85 KMT2A (0.59) NPC1RAB9AKMT2AMEN1MAPT
SCHEMBL6517554 0.85 KMT2A (0.59) NPC1RAB9AKMT2AMEN1MAPT
SCHEMBL6514323 0.80 NPC1 (0.62) NPC1RAB9AKMT2AMEN1MAPT
SCHEMBL6514316 0.80 NPC1 (0.62) NPC1RAB9AKMT2AMEN1MAPT
SCHEMBL6516050 0.78 KMT2A (0.69) NPC1RAB9AKMT2AMEN1MAPT
SCHEMBL6516056 0.78 KMT2A (0.69) NPC1RAB9AKMT2AMEN1MAPT
SCHEMBL6514402 0.78 KMT2A (0.69) NPC1RAB9AKMT2AMEN1MAPT
SCHEMBL6514410 0.78 KMT2A (0.69) NPC1RAB9AKMT2AMEN1MAPT
SCHEMBL600578 0.78 RAB9A (0.83) NPC1RAB9AKMT2AMEN1MAPT

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
US-6958366-B2 Antifouling coating composition and novel resin DAINIPPON INK AND CHEMICALS, INC. (JP) 2005-10-25 US disclosed
US-20030118544-A1 Antifouling coating composition and novel resin DAINIPPON INK AND CHEMICALS, INC. (JP) 2003-06-26 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-20030118544-A1 Antifouling coating composition and novel resin COL1A1, GLRA1, COL2A1 NPC1 3563/4885RAB9A 2333/4885KMT2A 1067/4885

“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.