SCHEMBL7542880

SCHEMBL7542880

O=Cc1cc(O)ccc1C(=O)c1ccc2ccccc2c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.54
KMT2A Q03164 4/20 0.54
NPC1 O15118 1/20 0.54
RAB9A P51151 1/20 0.54
CLK1 P49759 1/20 0.54
DYRK1A Q13627 1/20 0.54
DYRK1B Q9Y463 1/20 0.54
HSD17B14 Q9BPX1 1/20 0.47
CES2 O00748 1/20 0.46
CES1 P23141 1/20 0.46
MAPT P10636 2/20 0.46
MAPK1 P28482 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
CYP1A2 P05177 1/20 0.46
DEGS1 O15121 2/20 0.46
ESR1 P03372 2/20 0.46
ESR2 Q92731 2/20 0.46
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
EGFR P00533 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
SCHEMBL7542428 0.79 CES2 (0.46) MEN1KMT2AHSD17B14CES2CES1
SCHEMBL7535954 0.77 HSD17B14 (0.44) MEN1KMT2ANPC1RAB9ACLK1
SCHEMBL8479014 0.77 CASP3 (0.51) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL5383875 0.76 MEN1 (0.76) MEN1KMT2ANPC1RAB9ACLK1
SCHEMBL12295978 0.75 FASN (0.49) MEN1KMT2ANPC1RAB9ACLK1
SCHEMBL8393638 0.74 MEN1 (0.93) MEN1KMT2ANPC1RAB9ACLK1
SCHEMBL699740 0.74 MEN1 (0.56) MEN1KMT2ANPC1RAB9ACLK1
SCHEMBL941698 0.73 CES2 (0.74) MEN1KMT2ANPC1RAB9ACLK1
SCHEMBL29613672 0.73 CES2 (0.74) MEN1KMT2ANPC1RAB9ACLK1
SCHEMBL30250451 0.73 CES2 (0.74) MEN1KMT2ANPC1RAB9ACLK1

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-20020094993-A1 Compositions for repelling crawling insects S.C. JOHNSON & SON, INC. 2002-07-18 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-20020094993-A1 Compositions for repelling crawling insects ACHE, DDT, GAP43 MEN1 3828/4885KMT2A 3439/4885NPC1 4384/4885

“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.