Flupirtine

Flupirtine

SCHEMBL505400

CCCCCCCCC=CCCCCCCCC(=O)O.CCOC(=O)Nc1ccc(NCc2ccc(F)cc2)nc1N

nearest known ligand 0.72

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNQ3 O43525 5/20 0.72
KCNQ2 O43526 5/20 0.72
CYP3A4 P08684 2/20 0.72
ALOX15 P16050 2/20 0.72
HSD17B10 Q99714 2/20 0.72
ESR1 P03372 2/20 0.72
ABCB11 O95342 1/20 0.72
CYP1A2 P05177 1/20 0.72
HTR1A P08908 1/20 0.72
ADRA2A P08913 1/20 0.72
ADORA3 P0DMS8 1/20 0.72
CYP2D6 P10635 1/20 0.72
CYP2C9 P11712 1/20 0.72
NFKB1 P19838 1/20 0.72
TBXA2R P21731 1/20 0.72
MAPK1 P28482 1/20 0.72
CASP1 P29466 1/20 0.72
CYP2C19 P33261 1/20 0.72
SHMT2 P34897 1/20 0.72
PTGS2 P35354 1/20 0.72

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
Flupirtine SCHEMBL505399 1.00 KCNQ3 (0.72) KCNQ3KCNQ2CYP3A4ALOX15HSD17B10
Flupirtine SCHEMBL505704 0.95 KCNQ2 (0.80) KCNQ3KCNQ2CYP3A4ALOX15HSD17B10
Flupirtine SCHEMBL506155 0.95 KCNQ2 (0.80) KCNQ3KCNQ2CYP3A4ALOX15HSD17B10
Flupirtine SCHEMBL505518 0.95 KCNQ2 (0.80) KCNQ3KCNQ2CYP3A4ALOX15HSD17B10
Flupirtine SCHEMBL506291 0.95 KCNQ2 (0.80) KCNQ3KCNQ2CYP3A4ALOX15HSD17B10
Flupirtine SCHEMBL505659 0.95 KCNQ2 (0.80) KCNQ3KCNQ2CYP3A4ALOX15HSD17B10
Flupirtine SCHEMBL505798 0.95 KCNQ2 (0.80) KCNQ3KCNQ2CYP3A4ALOX15HSD17B10
Flupirtine SCHEMBL505638 0.94 KCNQ2 (0.81) KCNQ3KCNQ2CYP3A4ALOX15HSD17B10
Flupirtine SCHEMBL505702 0.88 KCNQ2 (0.90) KCNQ3KCNQ2CYP3A4ALOX15HSD17B10
Flupirtine SCHEMBL505476 0.85 KCNQ2 (0.92) KCNQ3KCNQ2CYP3A4ALOX15HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120028930-A1 FLUPIRTINE SALTS AND POLYMORPHS BIONEVIA PHARMACEUTICALS INC. (US) 2012-02-02 US 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-20120028930-A1 FLUPIRTINE SALTS AND POLYMORPHS SULT2A1, TACR1, NPSR1 KCNQ3 1107/4885KCNQ2 1153/4885CYP3A4 76/4885

“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.