SCHEMBL17347781

SCHEMBL17347781

CCOC(=O)c1c(F)ccc2c1OB(O)[C@@H](NC(=O)CC)C2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 1/20 0.36
▸ CYP11B2 P19099 5/20 0.35
▸ CYP11B1 P15538 3/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ HPGD P15428 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ TP53 P04637 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ MTNR1A P48039 1/20 0.34
▸ MTNR1B P49286 1/20 0.34
▸ CAT P04040 1/20 0.34
▸ THRB P10828 1/20 0.34
▸ CXCR2 P25025 1/20 0.34
▸ CXCR4 P61073 1/20 0.34
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ GRM6 O15303 1/20 0.33
▸ PRKCZ Q05513 1/20 0.33

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
SCHEMBL23129947 1.00 RAB9A (0.36) RAB9ACYP11B2CYP11B1ALDH1A1HPGD
SCHEMBL23130281 0.92 MTNR1A (0.36) RAB9AALDH1A1KDM4EHTTL3MBTL1
SCHEMBL17347697 0.92 MTNR1A (0.36) RAB9AALDH1A1KDM4EHTTL3MBTL1
SCHEMBL17347748 0.90 HTT (0.35) RAB9AALDH1A1KDM4EHTTL3MBTL1
SCHEMBL23130009 0.90 HTT (0.35) RAB9AALDH1A1KDM4EHTTL3MBTL1
SCHEMBL19663664 0.89 ALDH1A1 (0.34) RAB9AALDH1A1HPGDKDM4EMAPT
SCHEMBL23129709 0.88 CA12 (0.41) RAB9AALDH1A1HPGDMAPTMEN1
SCHEMBL17347783 0.88 CA12 (0.41) RAB9AALDH1A1HPGDMAPTMEN1
SCHEMBL23130145 0.88 CAT (0.46) CYP11B2CYP11B1MTNR1AMTNR1BCAT
SCHEMBL17347805 0.88 CAT (0.46) CYP11B2CYP11B1MTNR1AMTNR1BCAT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11008346-B2 Beta-lactamase inhibitors VenatoRx Pharmaceuticals, Inc. (US) 2021-05-18 — — US disclosed
EP-3154989-B1 BETA-LACTAMASE INHIBITORS VENATORX PHARMACEUTICALS INC (US) 2021-03-24 — — EP disclosed
US-20200361962-A1 BETA-LACTAMASE INHIBITORS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2020-11-19 — — US disclosed
US-9926336-B2 Beta-lactamase inhibitors VENATORX PHARMACEUTICALS (US) 2018-03-27 — — US disclosed
US-20170342092-A1 BETA-LACTAMASE INHIBITORS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2017-11-30 — — US disclosed
US-9783555-B2 Beta-lactamase inhibitors VenatoRx Pharmaceuticals, Inc. (US) 2017-10-10 — — US disclosed
US-20170226135-A1 BETA-LACTAMASE INHIBITORS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2017-08-10 — — US disclosed
US-9637504-B2 Beta-lactamase inhibitors VenatoRx Pharmaceuticals, Inc. (US) 2017-05-02 — — US disclosed
US-20160264598-A1 BETA-LACTAMASE INHIBITORS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2016-09-15 — — US disclosed
WO-2015191907-A1 BETA-LACTAMASE INHIBITORS VenatoRx Pharmaceuticals, Inc. (US) 2015-12-17 — — 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 (5 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-11008346-B2 Beta-lactamase inhibitors MGAM, GAA, LCT RAB9A 1933/4885CYP11B2 3160/4885CYP11B1 3226/4885
US-20170342092-A1 BETA-LACTAMASE INHIBITORS MGAM, GAA, LCT RAB9A 1933/4885CYP11B2 3160/4885CYP11B1 3226/4885
US-20200361962-A1 BETA-LACTAMASE INHIBITORS MGAM, GAA, LCT RAB9A 1933/4885CYP11B2 3160/4885CYP11B1 3226/4885
US-20170226135-A1 BETA-LACTAMASE INHIBITORS MGAM, GAA, LCT RAB9A 1933/4885CYP11B2 3160/4885CYP11B1 3226/4885
US-20160264598-A1 BETA-LACTAMASE INHIBITORS MGAM, GAA, LCT RAB9A 1933/4885CYP11B2 3160/4885CYP11B1 3226/4885

“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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