SCHEMBL30745980

SCHEMBL30745980

Fc1cc(/C(Cl)=N/N=C(\Cl)c2cc(F)c(Br)cc2F)c(F)cc1Br

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 6/20 0.36
KDM1B Q8NB78 4/20 0.36
KCNH2 Q12809 2/20 0.36
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
GPR27 Q9NS67 1/20 0.32

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
SCHEMBL27007899 1.00 KDM1A (0.36) KDM1AKDM1BKCNH2NPC1RAB9A
SCHEMBL27130651 1.00 KDM1A (0.36) KDM1AKDM1BKCNH2NPC1RAB9A
SCHEMBL15897828 0.86 KDM1A (0.35) KDM1AKDM1BKCNH2NPC1RAB9A
SCHEMBL591163 0.77 ALDH1A1 (0.43) KDM1AKDM1BKCNH2NPC1RAB9A
SCHEMBL15919054 0.77 KDM1A (0.37) KDM1AKDM1BKCNH2NPC1RAB9A
SCHEMBL27007781 0.73 DGAT1 (0.53) KDM1AKDM1BNPC1RAB9AGPR27
SCHEMBL27126049 0.73 DGAT1 (0.53) KDM1AKDM1BNPC1RAB9AGPR27
SCHEMBL9233541 0.72 CES2 (0.41) NPC1RAB9A
SCHEMBL9233543 0.72 CES2 (0.41) NPC1RAB9A
SCHEMBL505780 0.71 KDM1A (0.48) KDM1AKDM1BKCNH2NPC1RAB9A

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-20240018121-A1 NOVEL HETEROAROMATIC COMPOUNDS EXHIBITING ANTIFUNGAL ACTIVITY AND THEIR METHOD OF USE FOX CHASE CHEMCIAL DIVERSITY CENTER, INC. (US) 2024-01-18 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-20240018121-A1 NOVEL HETEROAROMATIC COMPOUNDS EXHIBITING ANTIFUNGAL ACTIVITY AND THEIR METHOD OF USE ERG28, CYP51A1, MANBA KDM1A 2291/4885KDM1B 2870/4885KCNH2 4665/4885

“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.