SCHEMBL29935671

SCHEMBL29935671

F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F.c1ccc2sc(-c3cc[n+](CCCCC[n+]4ccc(-c5nc6ccccc6s5)cc4)cc3)nc2c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.51
KDM4E B2RXH2 5/20 0.51
NPC1 O15118 5/20 0.51
APP P05067 5/20 0.50
MAPT P10636 3/20 0.50
GLA P06280 2/20 0.50
GAA P10253 2/20 0.50
PKM P14618 2/20 0.50
MMP9 P14780 2/20 0.50
MMP8 P22894 2/20 0.50
ALDH1A1 P00352 2/20 0.50
LMNA P02545 2/20 0.50
APOBEC3A P31941 1/20 0.50
APOBEC3G Q9HC16 1/20 0.50
SMN1; SMN2 Q16637 2/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
PAX8 Q06710 1/20 0.47
NOD2 Q9HC29 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47

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
Bromide SCHEMBL29935440 0.93 RAB9A (0.55) RAB9AKDM4ENPC1APPMAPT
SCHEMBL24566464 0.88 KDM4E (0.55) RAB9AKDM4ENPC1APPMAPT
SCHEMBL29935630 0.87 KDM4E (0.47) RAB9AKDM4ENPC1APPMAPT
Bromide SCHEMBL29935767 0.86 KDM4E (0.54) RAB9AKDM4ENPC1APPMAPT
Bromide SCHEMBL29935461 0.86 KDM4E (0.54) RAB9AKDM4ENPC1APPMAPT
Iodide SCHEMBL29737318 0.86 KDM4E (0.57) RAB9AKDM4ENPC1APPMAPT
SCHEMBL29935717 0.86 KDM4E (0.54) RAB9AKDM4ENPC1APPMAPT
SCHEMBL29737334 0.86 KDM4E (0.54) RAB9AKDM4ENPC1APPMAPT
SCHEMBL29935874 0.81 KDM4E (0.51) RAB9AKDM4ENPC1APPMAPT
Bromide SCHEMBL29935563 0.80 KDM4E (0.50) RAB9AKDM4ENPC1APPMAPT

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-20220332712-A1 HETEROARYL-PYRIDINIUM COMPOUND AND REDOX FLOW BATTERY COMPRISING THE SAME PUSAN NATIONAL UNIVERSITY INDUSTRY-UNIVERSITY COOPERATION FOUNDATION (KR) 2022-10-20 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-20220332712-A1 HETEROARYL-PYRIDINIUM COMPOUND AND REDOX FLOW BATTERY COMPRISING THE SAME NOX4, DUOX1, PNPO RAB9A 1298/4885KDM4E 2720/4885NPC1 4380/4885

“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.