SCHEMBL19856430

SCHEMBL19856430

CCOC(=O)C=CCN(CC=CC(=O)OCC)Cc1ccc(OC)cc1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
HTT P42858 1/20 0.46
TSPO P30536 1/20 0.45
KMT2A Q03164 2/20 0.44
GLA P06280 1/20 0.44
TDP1 Q9NUW8 1/20 0.43
ACHE P22303 3/20 0.43
BCHE P06276 2/20 0.42
TSHR P16473 1/20 0.42
MAPK1 P28482 1/20 0.42
TBXAS1 P24557 1/20 0.41
TAS2R14 Q9NYV8 2/20 0.41
APLNR P35414 1/20 0.40
MEN1 O00255 1/20 0.40

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
SCHEMBL18655432 1.00 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2HTTTSPOKMT2A
SCHEMBL20185942 0.96 KMT2A (0.44) ALDH1A1SMN1; SMN2HTTTSPOKMT2A
SCHEMBL20185941 0.96 KMT2A (0.44) ALDH1A1SMN1; SMN2HTTTSPOKMT2A
SCHEMBL28193701 0.87 ALDH1A1 (0.39) ALDH1A1SMN1; SMN2HTTTSPOKMT2A
SCHEMBL29849080 0.85 MAPT (0.51) ALDH1A1KMT2ATDP1MEN1
SCHEMBL12035649 0.81 KMT2A (0.49) ALDH1A1SMN1; SMN2HTTKMT2AGLA
SCHEMBL22164503 0.80 MAPT (0.47) ALDH1A1KMT2ATDP1MEN1
SCHEMBL22164501 0.80 MAPT (0.47) ALDH1A1KMT2ATDP1MEN1
SCHEMBL29879227 0.80 TBXAS1 (0.51) ALDH1A1SMN1; SMN2HTTTSPOKMT2A
SCHEMBL29136751 0.80 TBXAS1 (0.51) ALDH1A1SMN1; SMN2HTTTSPOKMT2A

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
CN-108619141-B Antibacterial composition and application thereof 山东轩竹医药科技有限公司 2021-09-10 CN disclosed
CN-108778270-B Antibacterial composition and application thereof 吉林四环制药有限公司 2021-07-30 CN disclosed
CN-107531709-B Beta-lactamase inhibitor and use thereof 吉林四环制药有限公司 2020-10-23 CN disclosed
US-10167283-B2 β-lactamase inhibitors and uses thereof SUANZHU PHARMA CO., LTD. (CN) 2019-01-01 US disclosed
US-20180148448-A1 ß-LACTAMASE INHIBITORS AND USES THEREOF Xuanzhu Pharma Co., Ltd. (CN) 2018-05-31 US disclosed
EP-3281942-A1 B-LACTAMASE INHIBITOR AND APPLICATION THEREOF Xuanzhu Pharma Co., Ltd. (CN) 2018-02-14 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 (2 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-10167283-B2 β-lactamase inhibitors and uses thereof MGAM, LCT, ALPI ALDH1A1 269/4885SMN1; SMN2 1461/4885HTT 4825/4885
US-20180148448-A1 ß-LACTAMASE INHIBITORS AND USES THEREOF MGAM, LCT, ALPI ALDH1A1 257/4885SMN1; SMN2 1429/4885HTT 4819/4885

“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.