SCHEMBL4875484

SCHEMBL4875484

C=C(CC(=O)c1ccccc1)C(=O)O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.67
MAPK1 P28482 3/20 0.67
HPGD P15428 3/20 0.67
KMT2A Q03164 3/20 0.67
MEN1 O00255 2/20 0.67
CYP3A4 P08684 2/20 0.67
TDP1 Q9NUW8 2/20 0.67
SMN1; SMN2 Q16637 2/20 0.67
KDM4E B2RXH2 1/20 0.67
ALOX15 P16050 1/20 0.67
CES1 P23141 1/20 0.67
ERCC5 P28715 4/20 0.63
FEN1 P39748 4/20 0.63
PTPN1 P18031 2/20 0.63
ALDH1A1 P00352 4/20 0.55
LMNA P02545 3/20 0.55
USP2 O75604 1/20 0.55
POLB P06746 1/20 0.55
HTT P42858 1/20 0.55
NPSR1 Q6W5P4 1/20 0.55

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
SCHEMBL11707718 0.88 HAO1 (0.68) MAPTMAPK1HPGDKMT2AMEN1
Benzene SCHEMBL11711818 0.84 HAO1 (0.59) MAPTMAPK1HPGDKMT2AMEN1
SCHEMBL11714725 0.84 ERCC5 (0.71) MAPTMAPK1HPGDKMT2AMEN1
SCHEMBL30951020 0.83 MAOA (0.50) MAPTMAPK1HPGDKMT2AMEN1
SCHEMBL11705647 0.82 ERCC5 (0.67) MAPTKMT2AMEN1KDM4EALOX15
SCHEMBL10649708 0.82 HAO1 (0.61) MAPTMAPK1HPGDKMT2AMEN1
SCHEMBL10645841 0.82 NPC1 (0.63) MAPTMAPK1HPGDKMT2AMEN1
SCHEMBL11709368 0.82 PLOD2 (0.55) MAPTMAPK1HPGDKMT2AMEN1
Dibenzoylmethane SCHEMBL10356288 0.81 MEN1 (1.00) MAPTMAPK1HPGDKMT2AMEN1
Dibenzoylmethane SCHEMBL1704711 0.81 MEN1 (1.00) MAPTMAPK1HPGDKMT2AMEN1

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7368458-B2 Bicyclic heterocycles as cannabinoid receptor modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2008-05-06 US disclosed
US-7368458-B2 Bicyclic heterocycles as cannabinoid receptor modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2008-05-06 US disclosed
US-7368458-B2 Bicyclic heterocycles as cannabinoid receptor modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2008-05-06 US disclosed
WO-2006076597-A1 BICYCLIC HETEROCYCLES AS CANNABINOID RECEPTOR MODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2006-07-20 WO disclosed
US-20060155126-A1 Bicyclic heterocycles as cannabinoid receptor modulators BRISTOL-MYERS SQUIBB COMPANY 2006-07-13 US disclosed
EP-0164101-B1 BENZOYLPROPIONIC ACID DERIVATIVES, THEIR USE AND PHARMACEUTICAL COMPOSITIONS TAISHO PHARMACEUTICAL CO. LTD (JP) 1988-09-07 EP disclosed
US-4600540-A &MMUNOLOGY, ANTIARTHRITIC, ANTICARCINOGENIC, BACTERICIDES, ASTHMA TAISHO PHARMACEUTICAL CO., LTD. (JP) 1986-07-15 US disclosed
EP-0164101-A2 Benzoylpropionic acid derivatives, their use and pharmaceutical compositions TAISHO PHARMACEUTICAL CO. LTD (JP) 1985-12-11 EP disclosed
US-4058558-A 2-METHYLENE-4-OXO-4(4'-ORTHO-CHLOROPHENYLPHENYL)BUTYRIC ACID PIERRE FABRE S.A. (FR) 1977-11-15 US disclosed
US-4008323-A Method of reducing cholesterol using certain aromatic keto acids PIERRE FABRE S.A. (FR) 1977-02-15 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-20060155126-A1 Bicyclic heterocycles as cannabinoid receptor modulators CNR1, CNR2, GPR18 MAPT 4202/4885MAPK1 2583/4885HPGD 1037/4885

“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.