SCHEMBL17347674

SCHEMBL17347674

CCC(=O)N[C@H]1Cc2cc(OC)cc(C(=O)OCOC(=O)C(C)(C)C)c2OB1O

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ MTNR1A P48039 1/20 0.30
▸ MTNR1B P49286 1/20 0.30
▸ CYP1A2 P05177 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ CYP2C9 P11712 1/20 0.30
▸ ALOX15 P16050 1/20 0.30

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
SCHEMBL23129647 1.00 POLB (0.30) POLBKMT2AMTNR1AMTNR1BCYP1A2
SCHEMBL23129891 0.93 MTNR1A (0.32) MTNR1AMTNR1B
SCHEMBL17347827 0.93 MTNR1A (0.32) MTNR1AMTNR1B
SCHEMBL17347809 0.91 MTNR1A (0.33) MTNR1AMTNR1B
SCHEMBL23129657 0.91 MTNR1A (0.33) MTNR1AMTNR1B
SCHEMBL23129656 0.89 PRKCB (0.32) —
SCHEMBL17347685 0.89 PRKCB (0.32) —
SCHEMBL17347676 0.88 PARP1 (0.31) —
SCHEMBL17347675 0.88 KDM4E (0.31) POLB
SCHEMBL23129900 0.88 PARP1 (0.31) —

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 POLB 404/4885KMT2A 915/4885MTNR1A 3641/4885
US-20170342092-A1 BETA-LACTAMASE INHIBITORS MGAM, GAA, LCT POLB 404/4885KMT2A 915/4885MTNR1A 3641/4885
US-20200361962-A1 BETA-LACTAMASE INHIBITORS MGAM, GAA, LCT POLB 404/4885KMT2A 915/4885MTNR1A 3641/4885
US-20170226135-A1 BETA-LACTAMASE INHIBITORS MGAM, GAA, LCT POLB 404/4885KMT2A 915/4885MTNR1A 3641/4885
US-20160264598-A1 BETA-LACTAMASE INHIBITORS MGAM, GAA, LCT POLB 404/4885KMT2A 915/4885MTNR1A 3641/4885

“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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