SCHEMBL17848889

SCHEMBL17848889

O=C(Cl)c1c(F)cc(-c2ccccc2)cc1F

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
AKR1C2 P52895 3/20 0.53
AKR1C1 Q04828 3/20 0.53
ALDH1A1 P00352 2/20 0.45
ALOX15 P16050 1/20 0.45
DHODH Q02127 3/20 0.41
RHEB Q15382 1/20 0.39
EGFR P00533 1/20 0.39
KMO O15229 1/20 0.38
PTPN1 P18031 1/20 0.38
KDM4E B2RXH2 1/20 0.38
LMNA P02545 1/20 0.38
HSD17B10 Q99714 1/20 0.38
TP53 P04637 1/20 0.37
FFAR1 O14842 1/20 0.37
MAP2 P11137 1/20 0.37
AKR1C4 P17516 1/20 0.37
AKR1C3 P42330 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
SCHEMBL28535010 0.94 AKR1C2 (0.53) AKR1C2AKR1C1ALDH1A1ALOX15DHODH
SCHEMBL505832 0.83 AKR1C2 (0.61) AKR1C2AKR1C1ALDH1A1DHODHEGFR
SCHEMBL10029672 0.83 AKR1C2 (0.56) AKR1C2AKR1C1ALDH1A1DHODHEGFR
SCHEMBL26352578 0.80 AKR1C2 (0.53) AKR1C2AKR1C1DHODHEGFRKDM4E
SCHEMBL29129812 0.78 AKR1C2 (0.50) AKR1C2AKR1C1ALDH1A1ALOX15EGFR
SCHEMBL4864533 0.77 ALDH1A1 (0.57) AKR1C2AKR1C1ALDH1A1ALOX15DHODH
SCHEMBL4603812 0.77 ACP3 (0.42) AKR1C2AKR1C1ALDH1A1
SCHEMBL30638614 0.76 DHODH (0.49) AKR1C2AKR1C1ALDH1A1DHODHEGFR
Biphenyl SCHEMBL2838517 0.73 AKR1C2 (0.50) AKR1C2AKR1C1ALDH1A1DHODHKMO
SCHEMBL105255 0.73 CES2 (0.64) ALDH1A1ALOX15LMNA

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 11 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-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
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 AKR1C2 3313/4885AKR1C1 3152/4885ALDH1A1 4807/4885

“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.