SCHEMBL9977598

SCHEMBL9977598

CC(C)(CC/C(=C/CCC(=O)O)c1ccc(F)cc1)[Si](C)(C)O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 6/20 0.37
FNTA P49354 1/20 0.34
FNTB P49356 1/20 0.34
POLB P06746 1/20 0.34
GAA P10253 1/20 0.34
ALDH1A1 P00352 1/20 0.33
HTR7 P34969 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
MMP2 P08253 1/20 0.31
MMP8 P22894 1/20 0.31
MMP12 P39900 1/20 0.31
ADAMTS5 Q9UNA0 1/20 0.31
PTGIS Q16647 2/20 0.31
KDM4E B2RXH2 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
PTGS1 P23219 1/20 0.31
PTGS2 P35354 1/20 0.31
LMNA P02545 1/20 0.31
TP53 P04637 1/20 0.31

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
SCHEMBL9977594 1.00 TBXAS1 (0.37) TBXAS1FNTAFNTBPOLBGAA
SCHEMBL9977596 0.87 CXCR1 (0.36) FNTAFNTBPOLBGAAALDH1A1
SCHEMBL9977601 0.87 CXCR1 (0.36) FNTAFNTBPOLBGAAALDH1A1
SCHEMBL9977571 0.83 PTGS1 (0.34) FNTAFNTBHTR7NPC1RAB9A
SCHEMBL9977545 0.83 PTGS1 (0.34) FNTAFNTBHTR7NPC1RAB9A
SCHEMBL9977551 0.82 PTGS1 (0.33) FNTAFNTBPTGS1PTGS2
SCHEMBL9977568 0.82 PTGS1 (0.33) FNTAFNTBPTGS1PTGS2
SCHEMBL9977570 0.79 HTR7 (0.33) POLBGAAHTR7NPC1RAB9A
SCHEMBL9977609 0.78 ADRB2 (0.34) POLBGAALMNA
SCHEMBL9977600 0.78 ADRB2 (0.34) POLBGAALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2465847-B1 AZETIDINONE COMPOUNDS AND MEDICAL USE THEREOF ZHEJIANG HISUN PHARM CO LTD (CN) 2016-10-12 EP disclosed
US-8623855-B2 Azetidinone compounds and medical use thereof ZHEJIANG HISUN PHARMACEUTICAL CO., LTD. (CN) 2014-01-07 US disclosed
US-20120208994-A1 AZETIDINONE COMPOUNDS AND MEDICAL USE THEREOF ZHEJIANG HISUN PHARMACEUTICAL CO., LTD. (CN) 2012-08-16 US disclosed
EP-2465847-A1 AZETIDINONE COMPOUNDS AND MEDICAL USE THEREOF Zhejiang Hisun Pharmaceutical Co. Ltd. (CN) 2012-06-20 EP 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-20120208994-A1 AZETIDINONE COMPOUNDS AND MEDICAL USE THEREOF CYP46A1, APOB, CETP TBXAS1 846/4885FNTA 684/4885FNTB 2906/4885

“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.