SCHEMBL24198724

SCHEMBL24198724

CCCC(C)(CC)C(=O)c1ccnc(Br)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 6/20 0.50
▸ CA12 O43570 2/20 0.36
▸ CA9 Q16790 2/20 0.36
▸ KDM5A P29375 2/20 0.34
▸ KDM5B Q9UGL1 2/20 0.34
▸ KDM1A O60341 1/20 0.34
▸ HDAC1 Q13547 1/20 0.34
▸ HDAC6 Q9UBN7 1/20 0.34
▸ PREP P48147 1/20 0.34
▸ ALDH1A1 P00352 2/20 0.33
▸ KDM2B Q8NHM5 1/20 0.32
▸ KDM4C Q9H3R0 1/20 0.32
▸ LMNA P02545 3/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ ANO1 Q5XXA6 1/20 0.31
▸ SMN1; SMN2 Q16637 2/20 0.31
▸ HTT P42858 1/20 0.31
▸ NPC1 O15118 1/20 0.30

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
SCHEMBL24198772 0.83 TAS1R3 (0.38) ARKDM5AKDM5BPREPALDH1A1
SCHEMBL24198795 0.83 TAS1R3 (0.38) ARCA12CA9KDM5AKDM5B
SCHEMBL24198783 0.82 AR (0.45) ARCA12CA9KDM1AHDAC1
SCHEMBL24198752 0.81 DDR1 (0.43) ALDH1A1LMNASMN1; SMN2HTTNPC1
SCHEMBL24198771 0.75 POLB (0.50) KDM4ECYP3A4TSHRSMN1; SMN2HTT
SCHEMBL17441422 0.72 HPGD (0.47) ARCA12CA9KDM1AHDAC1
SCHEMBL24198796 0.72 ELANE (0.32) ARKDM4E
SCHEMBL18994707 0.72 HPGD (0.47) HDAC6ALDH1A1SMN1; SMN2
SCHEMBL22735776 0.72 ACHE (0.45) ARKDM5AKDM5BKDM1AHDAC1
SCHEMBL30770731 0.72 ATM (0.45) ARCA12CA9KDM1AHDAC1

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-11225505-B2 Antimicrobial polymyxin derivative compounds MONASH UNIVERSITY (AU) 2022-01-18 — — 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-11225505-B2 Antimicrobial polymyxin derivative compounds VIP, PNKP, PEPD AR 4099/4885CA12 4814/4885CA9 4598/4885

“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.

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