SCHEMBL6776274

SCHEMBL6776274

COC(=O)c1cc(I)c(C(=O)O)cc1-c1ccccc1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.43
HPGD P15428 2/20 0.42
MYC P01106 1/20 0.42
SLC6A3 Q01959 5/20 0.40
SLC6A4 P31645 3/20 0.40
FTO Q9C0B1 1/20 0.40
NR4A2 P43354 1/20 0.40
SLC6A2 P23975 1/20 0.40
GABRA1 P14867 1/20 0.39
GABRG2 P18507 1/20 0.39
GABRB3 P28472 1/20 0.39
GABRA3 P34903 1/20 0.39
KDM4E B2RXH2 1/20 0.39
FGFR1 P11362 1/20 0.39
FGFR2 P21802 1/20 0.39
FGFR4 P22455 1/20 0.39
FGFR3 P22607 1/20 0.39
PDCD1 Q15116 1/20 0.38
CD274 Q9NZQ7 1/20 0.38
TSHR P16473 2/20 0.38

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
SCHEMBL6780722 0.93 SLC6A3 (0.42) HPGDMYCSLC6A3SLC6A4NR4A2
SCHEMBL6776244 0.81 NR4A2 (0.41) HPGDSLC6A3SLC6A4NR4A2SLC6A2
SCHEMBL6782252 0.80 LMNA (0.39) MCL1HPGDMYCSLC6A3SLC6A4
SCHEMBL628811 0.78 SLC6A3 (0.46) HPGDMYCSLC6A3SLC6A4NR4A2
SCHEMBL6775709 0.78 ALDH1A1 (0.51) HPGDSLC6A3SLC6A4NR4A2SLC6A2
SCHEMBL7576345 0.77 TTR (0.45) MCL1HPGDSLC6A3SLC6A4SLC6A2
SCHEMBL38659300 0.77 SLC6A3 (0.49) HPGDMYCSLC6A3SLC6A4SLC6A2
SCHEMBL28250780 0.77 SLC6A3 (0.49) HPGDMYCSLC6A3SLC6A4SLC6A2
Bicarbonate SCHEMBL27492792 0.76 SLC6A3 (0.54) MYCSLC6A3SLC6A4NR4A2SLC6A2
SCHEMBL9549 0.75 SLC6A3 (0.57) MYCSLC6A3SLC6A4NR4A2SLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6693123-B2 (4-(3-PYRIDYLAMINOMETHYLENE)-2-PHENYLBENZOYL)-N -METHYLMETHIONINE, METHYL ESTER FOR EXAMPLE; RESTENOSIS, HYPERPLASIA UNIVERSITY OF PITTSBURGH 2004-02-17 US disclosed
EP-0873123-B1 INHIBITORS OF PROTEIN ISOPRENYL TRANSFERASES UNIV PITTSBURGH (US) 2003-04-09 EP disclosed
US-20020193596-A1 Inhibitors of protein isoprenyl transferases UNIVERSITY OF PITTSBURGH (US) 2002-12-19 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-20020193596-A1 Inhibitors of protein isoprenyl transferases LANCL1, FNTB, DHCR7 MCL1 4480/4885HPGD 1043/4885MYC 2732/4885

“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.