SCHEMBL17860893

SCHEMBL17860893

CCCCCOP(=O)(O)C(F)(F)C(C)=O

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 11/20 0.52
LPAR2 Q9HBW0 7/20 0.52
LPAR1 Q92633 6/20 0.52
CES2 O00748 2/20 0.42
CYP3A4 P08684 1/20 0.39
S1PR2 O95136 1/20 0.39
S1PR1 P21453 1/20 0.39
S1PR3 Q99500 1/20 0.39
LPAR5 Q9H1C0 1/20 0.37

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
SCHEMBL17878608 0.82 LPAR3 (0.47) LPAR3LPAR2LPAR1CES2CYP3A4
SCHEMBL17860871 0.80 CYP3A4 (0.48) LPAR3LPAR2LPAR1CES2CYP3A4
SCHEMBL27959316 0.73 LPAR3 (0.62) LPAR3LPAR2LPAR1
SCHEMBL17860873 0.72 LMNA (0.33) LPAR3LPAR2LPAR1CES2CYP3A4
SCHEMBL16996799 0.72 LPAR3 (0.61) LPAR3LPAR2LPAR1CES2CYP3A4
SCHEMBL9396740 0.71 LPAR3 (0.55) LPAR3LPAR2LPAR1CYP3A4
SCHEMBL2459739 0.71 LPAR3 (0.65) LPAR3LPAR2LPAR1CYP3A4LPAR5
SCHEMBL1582974 0.71 LPAR3 (0.95) LPAR3LPAR2LPAR1CYP3A4LPAR5
SCHEMBL497151 0.71 LPAR3 (0.71) LPAR3LPAR2LPAR1CYP3A4LPAR5
SCHEMBL56778 0.71 LPAR3 (0.95) LPAR3LPAR2LPAR1CYP3A4LPAR5

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 4 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
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
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 LPAR3 2783/4885LPAR2 4266/4885LPAR1 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.