SCHEMBL6761892

SCHEMBL6761892

O=C(O)c1ccc(CN2Cc3cc(C#CCc4ccc5ccccc5c4)ccc3C2=O)cc1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 2/20 0.47
MMP13 P45452 4/20 0.44
SLC22A8 Q8TCC7 1/20 0.44
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
PTGER4 P35408 1/20 0.43
PTGER2 P43116 1/20 0.43
HDAC1 Q13547 2/20 0.41
PTPN1 P18031 1/20 0.40
ACP1 P24666 1/20 0.40
HDAC7 Q8WUI4 1/20 0.39
ITGB3 P05106 2/20 0.38
ITGA2B P08514 2/20 0.38
HPGD P15428 1/20 0.38
NR1H4 Q96RI1 1/20 0.37
ENPP2 Q13822 1/20 0.37

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
SCHEMBL6761897 0.78 ACACB (0.44) GRM5MMP13SLC22A8PTGER4PTGER2
SCHEMBL1065002 0.75 MEN1 (0.69) MEN1KMT2AHDAC1HDAC7HPGD
SCHEMBL6765858 0.75 MEN1 (0.46) GRM5MEN1KMT2APTGER4HDAC1
SCHEMBL6706890 0.74 MMP13 (0.55) GRM5MMP13SLC22A8MEN1KMT2A
SCHEMBL446687 0.73 SRD5A1 (0.49) MEN1KMT2AHDAC1HDAC7ITGB3
SCHEMBL6240857 0.73 MMP13 (0.50) GRM5MMP13SLC22A8MEN1KMT2A
SCHEMBL6767426 0.72 KMT2A (0.67) MMP13SLC22A8MEN1KMT2AHDAC1
SCHEMBL2021878 0.72 GRM5 (0.47) GRM5MEN1KMT2AHDAC1HDAC7
SCHEMBL2027157 0.71 HDAC1 (0.55) MMP13MEN1KMT2AHDAC1HDAC7
SCHEMBL6767627 0.71 GRM5 (0.43) GRM5MMP13HDAC1

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-20040038973-A1 Treating osteoarthritis or rheumatoid arthritis NAHRA JOE (US) 2004-02-26 US claimed
WO-2004014365-A1 PHTHALIMIDE DERIVATIVES AS MATRIX METALLOPROTEINASE INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2004-02-19 WO claimed
US-20040038973-A1 Treating osteoarthritis or rheumatoid arthritis NAHRA JOE (US) 2004-02-26 US disclosed
WO-2004014365-A1 PHTHALIMIDE DERIVATIVES AS MATRIX METALLOPROTEINASE INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2004-02-19 WO disclosed
WO-2004014365-A1 PHTHALIMIDE DERIVATIVES AS MATRIX METALLOPROTEINASE INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2004-02-19 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-20040038973-A1 Treating osteoarthritis or rheumatoid arthritis MMP13, MMP11, MMP9 GRM5 1279/4885MMP13 1/4885SLC22A8 404/4885

“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.