SCHEMBL19733052

SCHEMBL19733052

CC(C)(C)[Si](C)(C)OCC1C(C2CC2)=CC(=O)CN1C(=O)O

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 1/20 0.33
DUT P33316 3/20 0.33
TOP2A P11388 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
SCHEMBL28936445 1.00 FKBP1A (0.33) FKBP1ADUTTOP2A
SCHEMBL15319563 0.87 KMT2A (0.36) FKBP1ADUTTOP2A
SCHEMBL15319566 0.87 KMT2A (0.36) FKBP1ADUTTOP2A
SCHEMBL28714852 0.84 FKBP1A (0.32) FKBP1ADUTTOP2A
SCHEMBL19733021 0.84 FKBP1A (0.32) FKBP1ADUTTOP2A
SCHEMBL19733039 0.81 FKBP1A (0.31) FKBP1ADUTTOP2A
SCHEMBL28696651 0.80 FKBP1A (0.31) FKBP1ADUT
SCHEMBL19733035 0.74 DUT (0.36) FKBP1ADUTTOP2A
SCHEMBL28699542 0.74 DUT (0.36) FKBP1ADUTTOP2A
SCHEMBL21873983 0.72 FKBP1A (0.36) FKBP1ADUTTOP2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114591223-A Beta-lactamase inhibitor compounds 恩塔西斯治疗有限公司 2022-06-07 CN disclosed
CN-109715630-B Beta-lactamase inhibitor compounds 恩塔西斯治疗有限公司 2022-02-22 CN disclosed
EP-2834239-B1 HETEROBICYCLIC COMPOUNDS AS BETA-LACTAMASE INHIBITORS ENTASIS THERAPEUTICS LTD (GB) 2017-12-27 EP disclosed