SCHEMBL16620335

SCHEMBL16620335

C[C@@H]1O[C@@H](OCCNC(=O)CCCCCNC(=O)CN(CC(=O)O)CC(=O)NCCCCCC(=O)OCc2ccccc2)[C@@H](O)[C@H](O)[C@@H]1O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 1/20 0.40
▸ SIRT2 Q8IXJ6 2/20 0.38
▸ MMP13 P45452 1/20 0.37
▸ PRCP P42785 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ TPSAB1 Q15661 2/20 0.35
▸ TPSD1 Q9BZJ3 2/20 0.35
▸ TPSG1 Q9NRR2 2/20 0.35
▸ FGF1 P05230 4/20 0.35
▸ VEGFA P15692 2/20 0.35
▸ SELP P16109 1/20 0.35
▸ LMNA P02545 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ PLG P00747 1/20 0.34
▸ ELANE P08246 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34

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
SCHEMBL23575125 0.98 EPHX2 (0.41) EPHX2SIRT2MMP13PRCPMEN1
SCHEMBL16621421 0.96 EPHX2 (0.43) EPHX2SIRT2MMP13PRCPMEN1
SCHEMBL20510407 0.94 HTT (0.42) SIRT2MMP13MEN1KMT2ATPSAB1
SCHEMBL30391643 0.90 HTT (0.43) SIRT2MEN1KMT2AFGF1VEGFA
SCHEMBL30891263 0.90 HTT (0.43) SIRT2MEN1KMT2AFGF1VEGFA
SCHEMBL25202164 0.90 EPHX2 (0.41) EPHX2PRCPMEN1ALDH1A1HPGD
SCHEMBL25196286 0.90 EPHX2 (0.41) EPHX2PRCPMEN1ALDH1A1HPGD
SCHEMBL30891267 0.90 EPOR (0.42) EPHX2SIRT2MEN1ALDH1A1HPGD
SCHEMBL30891349 0.90 EPOR (0.42) EPHX2SIRT2MEN1ALDH1A1HPGD
SCHEMBL23574920 0.90 SIRT2 (0.44) SIRT2MEN1ALDH1A1HPGDKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3052134-B1 GLUCOSE-RESPONSIVE INSULIN CONJUGATES MERCK SHARP & DOHME (US) 2021-05-05 — — EP disclosed
US-20180110863-A1 GLUCOSE-RESPONSIVE INSULIN CONJUGATES MERCK SHARP & DOHME CORP. (US) 2018-04-26 — — US disclosed
EP-3280450-A1 GLUCOSE-RESPONSIVE INSULIN CONJUGATES Merck Sharp & Dohme Corp. (US) 2018-02-14 — — EP disclosed
US-9889205-B2 Glucose-responsive insulin conjugates MERCK SHARP & DOHME CORP. (US) 2018-02-13 — — US disclosed
US-9884125-B2 Glucose-responsive insulin conjugates MERCK SHARP & DOHME CORP. (US) 2018-02-06 — — US disclosed
US-20160303244-A1 GLUCOSE-RESPONSIVE INSULIN CONJUGATES MERCK SHARP & DOHME CORP. (US) 2016-10-20 — — US disclosed
WO-2016164288-A1 GLUCOSE-RESPONSIVE INSULIN CONJUGATES MERCK SHARP & DOHME CORP. (US) 2016-10-13 — — WO disclosed
US-20160251407-A1 GLUCOSE-RESPONSIVE INSULIN CONJUGATES MERCK SHARP & DOHME CORP. (US) 2016-09-01 — — US disclosed
US-9427475-B2 Glucose-responsive insulin conjugates MERCK SHARP & DOHME CORP. (US) 2016-08-30 — — US disclosed
EP-3052134-A2 GLUCOSE-RESPONSIVE INSULIN CONJUGATES Merck Sharp & Dohme Corp. (US) 2016-08-10 — — EP disclosed
US-20150105317-A1 GLUCOSE-RESPONSIVE INSULIN CONJUGATES MERCK SHARP & DOHME LLC 2015-04-16 — — US disclosed
WO-2015051052-A2 GLUCOSE-RESPONSIVE INSULIN CONJUGATES MERCK SHARP & DOHME CORP. (US) 2015-04-09 — — 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 (4 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-20180110863-A1 GLUCOSE-RESPONSIVE INSULIN CONJUGATES GPR119, INSR, IRS1 EPHX2 3029/4885SIRT2 1189/4885MMP13 3723/4885
US-20150105317-A1 GLUCOSE-RESPONSIVE INSULIN CONJUGATES GPR119, INSR, IRS1 EPHX2 3275/4885SIRT2 1096/4885MMP13 3215/4885
US-20160251407-A1 GLUCOSE-RESPONSIVE INSULIN CONJUGATES GPR119, INSR, IRS1 EPHX2 3333/4885SIRT2 1124/4885MMP13 3498/4885
US-20160303244-A1 GLUCOSE-RESPONSIVE INSULIN CONJUGATES GPR119, INSR, IRS1 EPHX2 3275/4885SIRT2 1096/4885MMP13 3215/4885

“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.

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