SCHEMBL4606539

SCHEMBL4606539

CCCNc1ccccc1Oc1ccc(NC(=O)CC)c(C(=O)O)c1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MTNR1B P49286 1/20 0.50
POLB P06746 3/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
ATM Q13315 1/20 0.48
KDM4E B2RXH2 6/20 0.47
ALDH1A1 P00352 4/20 0.47
PKM P14618 2/20 0.47
PYGM P11217 4/20 0.46
PYGL P06737 3/20 0.46
HSD17B10 Q99714 2/20 0.44
ADRA2C P18825 1/20 0.43
CYP2C9 P11712 1/20 0.43
HPGD P15428 1/20 0.43
GAA P10253 2/20 0.43

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
SCHEMBL4604342 0.91 KDM4E (0.49) MTNR1BPOLBL3MBTL1ATMKDM4E
SCHEMBL4604249 0.91 POLB (0.54) MTNR1BPOLBL3MBTL1ATMKDM4E
SCHEMBL4603669 0.86 ALDH1A1 (0.53) MTNR1BPOLBL3MBTL1ATMKDM4E
SCHEMBL4604961 0.85 ALDH1A1 (0.48) MTNR1BPOLBL3MBTL1ATMKDM4E
SCHEMBL4603683 0.84 PYGM (0.62) PYGMPYGL
SCHEMBL4606880 0.83 KMT2A (0.57) MTNR1BPOLBL3MBTL1ATMKDM4E
SCHEMBL4605334 0.83 KDM4E (0.52) POLBL3MBTL1KDM4EALDH1A1PKM
SCHEMBL4605144 0.83 KDM4E (0.49) POLBKDM4EALDH1A1PKMHSD17B10
SCHEMBL4605135 0.82 KDM4E (0.49) POLBL3MBTL1KDM4EALDH1A1PKM
SCHEMBL4606525 0.82 CTSV (0.47) MTNR1BPOLBL3MBTL1ATMKDM4E

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
EP-1720825-B1 ANTHRANILIC ACID DERIVATIVES, METHODS FOR THEIR PREPARATION AND USE AS DHODH INHIBITORS ACTIVE BIOTECH AB (SE) 2008-07-09 EP disclosed
EP-1720825-A1 NEW COMPOUNDS, METHODS FOR THEIR PREPARATION AND USE THEREOF Active Biotech AB (SE) 2006-11-15 EP disclosed
US-7074831-B2 Compounds, methods for their preparation and use thereof ACTIVE BIOTECH AB (SE) 2006-07-11 US disclosed
US-20050187297-A1 New compounds, methods for their preparation and use thereof ACTIVE BIOTECH AB (SE) 2005-08-25 US disclosed
WO-2005075410-A1 NEW COMPOUNDS, METHODS FOR THEIR PREPARATION AND USE THEREOF ACTIVE BIOTECH AB (SE) 2005-08-18 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-20050187297-A1 New compounds, methods for their preparation and use thereof MALT1, TPMT, FUCA1 MTNR1B 1361/4885POLB 2352/4885L3MBTL1 4100/4885

“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.