Mefloquine

Mefloquine

SCHEMBL8575605

O[C@@H](c1cc(C(F)(F)F)nc2c(C(F)(F)F)cccc12)C1CCCCN1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 8/20 1.00
CYP2D6 P10635 6/20 1.00
ADORA2A P29274 5/20 1.00
ADORA1 P30542 5/20 1.00
CYP3A4 P08684 4/20 1.00
CYP1A2 P05177 4/20 1.00
CYP2C19 P33261 3/20 1.00
ADORA3 P0DMS8 2/20 1.00
ADORA2B P29275 1/20 1.00
ABCG2 Q9UNQ0 1/20 1.00
KDM4E B2RXH2 1/20 1.00
NR1I2 O75469 1/20 1.00
LMNA P02545 1/20 1.00
TP53 P04637 1/20 1.00
HTR1A P08908 1/20 1.00
TSHR P16473 1/20 1.00
CNR1 P21554 1/20 1.00
GLRA1 P23415 1/20 1.00
SLC6A2 P23975 1/20 1.00
HTR2A P28223 1/20 1.00

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
(S,R)-Mefloquine SCHEMBL32385911 1.00 KCNH2 (1.00) KCNH2CYP2D6ADORA2AADORA1CYP3A4
(S,R)-Mefloquine SCHEMBL16702641 1.00 KCNH2 (1.00) KCNH2CYP2D6ADORA2AADORA1CYP3A4
(R,R)-Mefloquine SCHEMBL21781 1.00 KCNH2 (1.00) KCNH2CYP2D6ADORA2AADORA1CYP3A4
Mefloquine SCHEMBL17087807 1.00 KCNH2 (1.00) KCNH2CYP2D6ADORA2AADORA1CYP3A4
(S,S)-Mefloquine SCHEMBL7278974 1.00 KCNH2 (1.00) KCNH2CYP2D6ADORA2AADORA1CYP3A4
Mefloquine SCHEMBL3625982 1.00 KCNH2 (1.00) KCNH2CYP2D6ADORA2AADORA1CYP3A4
Mefloquine SCHEMBL21782 1.00 KCNH2 (1.00) KCNH2CYP2D6ADORA2AADORA1CYP3A4
Mefloquine SCHEMBL7130867 1.00 KCNH2 (1.00) KCNH2CYP2D6ADORA2AADORA1CYP3A4
(S,R)-Mefloquine SCHEMBL21780 1.00 KCNH2 (1.00) KCNH2CYP2D6ADORA2AADORA1CYP3A4
Mefloquine SCHEMBL29433990 1.00 KCNH2 (1.00) KCNH2CYP2D6ADORA2AADORA1CYP3A4

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-0966285-A1 USE OF (+)MEFLOQUINE FOR THE TREATMENT OF MALARIA Cerebrus Pharmaceuticals Limited (GB) 1999-12-29 EP claimed
WO-1998039003-A1 USE OF (+)MEFLOQUINE FOR THE TREATMENT OF MALARIA CEREBRUS LIMITED (GB) 1998-09-11 WO claimed
US-11033572-B2 Molecular adjuvants for enhanced cytosolic delivery of active agents UNIVERSITEIT GENT (BE) 2021-06-15 US disclosed
US-20190328768-A1 MOLECULAR ADJUVANTS FOR ENHANCED CYTOSOLIC DELIVERY OF ACTIVE AGENTS UNIVERSITEIT GENT (BE) 2019-10-31 US disclosed
US-10420761-B2 Allosteric inhibitors of thymidylate synthase UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2019-09-24 US disclosed
US-20160067240-A1 NOVEL ALLOSTERIC INHIBITORS OF THYMIDYLATE SYNTHASE UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2016-03-10 US disclosed
WO-2014145386-A2 NOVEL ALLOSTERIC INHIBITORS OF THYMIDYLATE SYNTHASE UNIVERSITY OF FLORIDA RESEARCH FOUNDATION INCORPORATED (US) 2014-09-18 WO disclosed
EP-0966285-A1 USE OF (+)MEFLOQUINE FOR THE TREATMENT OF MALARIA Cerebrus Pharmaceuticals Limited (GB) 1999-12-29 EP disclosed
WO-1998039003-A1 USE OF (+)MEFLOQUINE FOR THE TREATMENT OF MALARIA CEREBRUS LIMITED (GB) 1998-09-11 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 (4 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-11033572-B2 Molecular adjuvants for enhanced cytosolic delivery of active agents TLR9, PLA2G4C, STING1 KCNH2 4606/4885CYP2D6 4831/4885ADORA2A 845/4885
US-10420761-B2 Allosteric inhibitors of thymidylate synthase MCL1, GLS, TYMS KCNH2 4326/4885CYP2D6 1555/4885ADORA2A 1184/4885
US-20160067240-A1 NOVEL ALLOSTERIC INHIBITORS OF THYMIDYLATE SYNTHASE GLS, MCL1, TYMS KCNH2 4325/4885CYP2D6 2168/4885ADORA2A 1160/4885
US-20190328768-A1 MOLECULAR ADJUVANTS FOR ENHANCED CYTOSOLIC DELIVERY OF ACTIVE AGENTS TLR9, PLA2G4C, STING1 KCNH2 4606/4885CYP2D6 4831/4885ADORA2A 845/4885

“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.