SCHEMBL5873228

SCHEMBL5873228

C=Cc1cc(C=C)cc(C(=O)CC(=O)c2ccccc2)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.61
KMT2A Q03164 5/20 0.61
MEN1 O00255 4/20 0.61
MAPT P10636 4/20 0.61
MAPK1 P28482 3/20 0.61
SMN1; SMN2 Q16637 3/20 0.61
CYP3A4 P08684 2/20 0.61
ALOX15 P16050 2/20 0.61
TDP1 Q9NUW8 2/20 0.61
KDM4E B2RXH2 2/20 0.61
CES1 P23141 1/20 0.61
ALDH1A1 P00352 5/20 0.50
NPC1 O15118 4/20 0.50
RAB9A P51151 3/20 0.50
PLOD2 O00469 2/20 0.50
HIF1A Q16665 2/20 0.50
PLOD3 O60568 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP2D6 P10635 1/20 0.50
CYP2C9 P11712 1/20 0.50

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
SCHEMBL1720943 0.88 MEN1 (0.59) HPGDKMT2AMEN1MAPTMAPK1
SCHEMBL5873182 0.85 HPGD (0.65) HPGDKMT2AMEN1MAPTMAPK1
Dibenzoylmethane SCHEMBL11587518 0.80 MEN1 (0.94) HPGDKMT2AMEN1MAPTMAPK1
Dibenzoylmethane SCHEMBL1704711 0.78 MEN1 (1.00) HPGDKMT2AMEN1MAPTMAPK1
Dibenzoylmethane SCHEMBL10356288 0.78 MEN1 (1.00) HPGDKMT2AMEN1MAPTMAPK1
Dibenzoylmethane SCHEMBL39582 0.78 MEN1 (1.00) HPGDKMT2AMEN1MAPTMAPK1
SCHEMBL5873209 0.77 ALDH1A1 (0.50) HPGDKMT2AMEN1MAPTMAPK1
Dibenzoylmethane SCHEMBL531257 0.76 MEN1 (0.94) HPGDKMT2AMEN1MAPTMAPK1
Dibenzoylmethane SCHEMBL6598370 0.76 MEN1 (0.94) HPGDKMT2AMEN1MAPTMAPK1
Dibenzoylmethane SCHEMBL21597905 0.76 MEN1 (0.94) HPGDKMT2AMEN1MAPTMAPK1

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-7067702-B2 Process for preparing vinyl substituted beta-diketones THE JOHNS HOPKINS UNIVERSITY (US) 2006-06-27 US disclosed
US-20060069288-A1 Process for preparing vinyl substituted beta-diketones THE JOHNS HOPKINS UNIVERSITY 2006-03-30 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-20060069288-A1 Process for preparing vinyl substituted beta-diketones VRK1, VRK2, DEK HPGD 1787/4885KMT2A 1338/4885MEN1 2957/4885

“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.