SCHEMBL17848859

SCHEMBL17848859

CCCCOP(=O)(NCC(=O)O)OCCCC

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.47
LPAR3 Q9UBY5 5/20 0.41
LPAR1 Q92633 3/20 0.41
LPAR2 Q9HBW0 3/20 0.41
ALDH1A1 P00352 2/20 0.39
LMNA P02545 1/20 0.39
TSHR P16473 1/20 0.37
PLA2G2A P14555 1/20 0.36
THRA P10827 1/20 0.35
THRB P10828 1/20 0.35

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
SCHEMBL4583913 0.76 CYP3A4 (0.54) CYP3A4LPAR3LPAR1LPAR2TSHR
SCHEMBL11162441 0.74 LPAR3 (0.50) CYP3A4LPAR3LPAR1LPAR2LMNA
SCHEMBL17956594 0.74 CYP3A4 (0.56) CYP3A4LPAR3LPAR1LPAR2ALDH1A1
SCHEMBL17860954 0.73 CYP3A4 (0.50) CYP3A4LPAR3LPAR1LPAR2ALDH1A1
SCHEMBL22528291 0.73 CYP3A4 (0.50) CYP3A4LPAR3LPAR1LPAR2LMNA
SCHEMBL28674444 0.72 CYP3A4 (0.48) CYP3A4LPAR3LPAR1LPAR2TSHR
SCHEMBL1784617 0.72 CYP3A4 (0.48) CYP3A4LPAR3LPAR1LPAR2ALDH1A1
SCHEMBL10365939 0.72 CYP3A4 (0.48) CYP3A4LPAR3LPAR1LPAR2TSHR
SCHEMBL3633114 0.71 EGLN1 (0.41) ALDH1A1LMNATSHR
Bicarbonate SCHEMBL28559959 0.71 CYP3A4 (0.81) CYP3A4LPAR3LPAR1LPAR2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3233889-B1 ANTIMICROBIAL POLYMYXINS FOR TREATMENT OF BACTERIAL INFECTIONS SHANGHAI MICURX PHARMACEUTICAL CO LTD (CN) 2022-07-06 EP disclosed
CN-107257803-B Polymyxin antibacterial agents for the treatment of bacterial infections 上海盟科药业股份有限公司 2021-02-05 CN disclosed
EP-3233889-A2 ANTIMICROBIAL POLYMYXINS FOR TREATMENT OF BACTERIAL INFECTIONS Micurx Pharmaceuticals, Inc. (US) 2017-10-25 EP disclosed
CN-107257803-A Polymyxins antiseptic for treating bacterium infection 盟科医药技术公司(开曼群岛) 2017-10-17 CN disclosed
US-9771394-B2 Antimicrobial polymyxins for treatment of bacterial infections MICURX PHARMACEUTICALS, INC. (KY) 2017-09-26 US disclosed
US-9771394-B2 Antimicrobial polymyxins for treatment of bacterial infections MICURX PHARMACEUTICALS, INC. (KY) 2017-09-26 US disclosed
US-20160185823-A1 ANTIMICROBIAL POLYMYXINS FOR TREATMENT OF BACTERIAL INFECTIONS MICURX PHARMACEUTICALS, INC. 2016-06-30 US disclosed
US-20160185823-A1 ANTIMICROBIAL POLYMYXINS FOR TREATMENT OF BACTERIAL INFECTIONS MICURX PHARMACEUTICALS, INC. 2016-06-30 US disclosed
WO-2016100578-A2 ANTIMICROBIAL POLYMYXINS FOR TREATMENT OF BACTERIAL INFECTIONS MICURX PHARMACEUTICALS, INC. (US) 2016-06-23 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 (1 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-20160185823-A1 ANTIMICROBIAL POLYMYXINS FOR TREATMENT OF BACTERIAL INFECTIONS VIP, AQP1, PEF1 CYP3A4 3756/4885LPAR3 2783/4885LPAR1 3457/4885

“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.