SCHEMBL4006005

SCHEMBL4006005

COC(=O)c1ccc(-c2cc(C(=O)O)c3ccccc3n2)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 6/20 0.70
KDM4E B2RXH2 6/20 0.69
LMNA P02545 3/20 0.69
SMN1; SMN2 Q16637 3/20 0.69
PDE10A Q9Y233 2/20 0.69
POLB P06746 1/20 0.67
ALDH1A1 P00352 5/20 0.66
KMT2A Q03164 4/20 0.66
MEN1 O00255 3/20 0.66
HPGD P15428 3/20 0.66
TP53 P04637 1/20 0.66
GLA P06280 1/20 0.66
GAA P10253 1/20 0.66
ALOX15 P16050 1/20 0.66
HSD17B10 Q99714 1/20 0.66
MAPT P10636 2/20 0.64
ALOX5 P09917 1/20 0.64
ALOX12 P18054 1/20 0.64
NPC1 O15118 2/20 0.64
RAB9A P51151 2/20 0.64

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
SCHEMBL22471916 0.87 PLA2G2A (0.65) DHODHKDM4ELMNASMN1; SMN2PDE10A
SCHEMBL1897303 0.86 DHODH (0.65) DHODHKDM4ELMNASMN1; SMN2PDE10A
SCHEMBL8689228 0.86 DHODH (0.82) DHODHKDM4ELMNASMN1; SMN2PDE10A
SCHEMBL116026 0.85 KDM4E (0.85) DHODHKDM4ELMNASMN1; SMN2PDE10A
SCHEMBL1899209 0.85 DHODH (0.76) DHODHKDM4ELMNASMN1; SMN2PDE10A
SCHEMBL2576382 0.85 KDM4E (0.76) DHODHKDM4ELMNASMN1; SMN2PDE10A
SCHEMBL4208879 0.84 PLA2G2A (0.79) DHODHKDM4ELMNASMN1; SMN2ALDH1A1
SCHEMBL29536364 0.83 DHODH (1.00) DHODHKDM4ELMNASMN1; SMN2PDE10A
SCHEMBL2467110 0.83 DHODH (1.00) DHODHKDM4ELMNASMN1; SMN2PDE10A
Cinchophen SCHEMBL25519 0.83 KDM4E (1.00) DHODHKDM4ELMNASMN1; SMN2PDE10A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090306133-A1 New Acetyl Coenzyme A Carboxylase (ACC) Inhibitors And Uses In Treatments Of Obesity And Diabetes Mellitus - 087 ASTRAZENECA AB (SE) 2009-12-10 US disclosed
US-20090306133-A1 New Acetyl Coenzyme A Carboxylase (ACC) Inhibitors And Uses In Treatments Of Obesity And Diabetes Mellitus - 087 ASTRAZENECA AB (SE) 2009-12-10 US disclosed
US-20090306133-A1 New Acetyl Coenzyme A Carboxylase (ACC) Inhibitors And Uses In Treatments Of Obesity And Diabetes Mellitus - 087 ASTRAZENECA AB (SE) 2009-12-10 US disclosed
WO-2009082346-A1 NEW ACETYL COENZYME A CARBOXYLASE (ACC) INHIBITORS AND USES IN TREATMENTS OF OBESITY AND DIABETES MELLITUS - 087 ASTRAZENECA AB (SE) 2009-07-02 WO disclosed
WO-2009082346-A1 NEW ACETYL COENZYME A CARBOXYLASE (ACC) INHIBITORS AND USES IN TREATMENTS OF OBESITY AND DIABETES MELLITUS - 087 ASTRAZENECA AB (SE) 2009-07-02 WO 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-20090306133-A1 New Acetyl Coenzyme A Carboxylase (ACC) Inhibitors And Uses In Treatments Of Obesity And Diabetes Mellitus - 087 ACACA, ACACB, ACAT1 DHODH 1103/4885KDM4E 1761/4885LMNA 1593/4885

“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.