SCHEMBL4543328

SCHEMBL4543328

CCC/C=C1\C=Cc2ccccc2C1=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
MAPT P10636 3/20 0.48
ALDH1A1 P00352 3/20 0.48
ALOX15 P16050 2/20 0.48
PKM P14618 2/20 0.48
KDM4E B2RXH2 1/20 0.48
BCHE P06276 1/20 0.48
POLB P06746 1/20 0.48
PTPRC P08575 1/20 0.48
THRB P10828 1/20 0.48
IDO1 P14902 1/20 0.48
HPGD P15428 1/20 0.48
PTPN1 P18031 1/20 0.48
ACHE P22303 1/20 0.48
CES1 P23141 1/20 0.48
RECQL P46063 1/20 0.48
HSD17B10 Q99714 1/20 0.48
PTPN22 Q9Y2R2 1/20 0.48

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
SCHEMBL4543331 1.00 LMNA (0.48) LMNAMEN1KMT2AMAPTALDH1A1
SCHEMBL4543140 0.90 MEN1 (0.46) LMNAMEN1KMT2AMAPTALDH1A1
SCHEMBL4543141 0.90 MEN1 (0.46) LMNAMEN1KMT2AMAPTALDH1A1
SCHEMBL170602 0.78 MEN1 (0.55) LMNAMEN1KMT2AMAPTALDH1A1
SCHEMBL4540846 0.78 LMNA (0.53) LMNAMEN1KMT2AMAPTALDH1A1
SCHEMBL4540847 0.78 LMNA (0.53) LMNAMEN1KMT2AMAPTALDH1A1
SCHEMBL11270876 0.76 CYP1A2 (0.42) LMNAMEN1KMT2AALOX15TRPA1
SCHEMBL11270872 0.76 CYP1A2 (0.42) LMNAMEN1KMT2AALOX15TRPA1
SCHEMBL16379092 0.72 KDM4E (0.48) LMNAMEN1KMT2AMAPTALDH1A1
1,2-Naphthoquinone SCHEMBL27880767 0.72 PTPRC (0.83) LMNAMEN1KMT2AMAPTALDH1A1

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-20090062401-A1 DECALINE-DERIVED COMPOUNDS AS PHARMACEUTICALLY ACTIVE AGENTS UNIVERSITAT DORTMUND (DE) 2009-03-05 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-20090062401-A1 DECALINE-DERIVED COMPOUNDS AS PHARMACEUTICALLY ACTIVE AGENTS CHAT, DLAT, CPT1A LMNA 1954/4885MEN1 1178/4885KMT2A 3695/4885

“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.