SCHEMBL9943473

SCHEMBL9943473

COC(=O)C(C/C=C(\CO[Si](C)(C)C(C)(C)C)c1ccc(F)cc1)C(=O)OC

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BTN3A1 O00481 4/20 0.40
ADRB2 P07550 2/20 0.39
ADRB1 P08588 2/20 0.39
ADRB3 P13945 2/20 0.39
LMNA P02545 2/20 0.37
TSHR P16473 1/20 0.32
NOS3 P29474 3/20 0.32
NOS1 P29475 3/20 0.32
NOS2 P35228 3/20 0.32
CXCR1 P25024 1/20 0.32
CXCR2 P25025 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ALDH1A1 P00352 1/20 0.32
KDM4E B2RXH2 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
SCHEMBL9943474 1.00 BTN3A1 (0.40) BTN3A1ADRB2ADRB1ADRB3LMNA
SCHEMBL9943576 1.00 BTN3A1 (0.40) BTN3A1ADRB2ADRB1ADRB3LMNA
SCHEMBL9943672 0.96 BTN3A1 (0.41) BTN3A1ADRB2ADRB1ADRB3LMNA
SCHEMBL9943703 0.96 BTN3A1 (0.41) BTN3A1ADRB2ADRB1ADRB3LMNA
SCHEMBL9943671 0.96 BTN3A1 (0.41) BTN3A1ADRB2ADRB1ADRB3LMNA
SCHEMBL11920539 0.81 LMNA (0.40) BTN3A1ADRB2ADRB1ADRB3LMNA
SCHEMBL11920543 0.81 LMNA (0.40) BTN3A1ADRB2ADRB1ADRB3LMNA
SCHEMBL9943524 0.79 LMNA (0.33) BTN3A1ADRB2ADRB1ADRB3LMNA
SCHEMBL9943652 0.79 LMNA (0.33) BTN3A1ADRB2ADRB1ADRB3LMNA
SCHEMBL9943525 0.79 LMNA (0.33) BTN3A1ADRB2ADRB1ADRB3LMNA

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 6 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-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
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 BTN3A1 3745/4885ADRB2 350/4885ADRB1 142/4885

“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.