SCHEMBL3522915

SCHEMBL3522915

Cc1ccc(C(=O)CCC(=O)NCC2CN(c3cccc(F)c3C3CCNC3)C(=O)O2)c(C)c1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ACKR3 P25106 1/20 0.38
MAOA P21397 6/20 0.36
MAOB P27338 5/20 0.36
LMNA P02545 2/20 0.36
PTGS1 P23219 2/20 0.36
SDHA P31040 2/20 0.36
CALML3 P27482 1/20 0.36
F10 P00742 4/20 0.35
TSHR P16473 1/20 0.34
GRM2 Q14416 1/20 0.33

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
SCHEMBL3522909 1.00 ACKR3 (0.38) ACKR3MAOAMAOBLMNAPTGS1
SCHEMBL3522655 0.95 F10 (0.39) ACKR3MAOAMAOBLMNAPTGS1
SCHEMBL3522661 0.95 F10 (0.39) ACKR3MAOAMAOBLMNAPTGS1
SCHEMBL3522781 0.92 PKM (0.37) ACKR3MAOAMAOBLMNAPTGS1
SCHEMBL3522784 0.92 PKM (0.37) ACKR3MAOAMAOBLMNAPTGS1
SCHEMBL3523457 0.87 F10 (0.39) MAOAMAOBLMNAPTGS1SDHA
SCHEMBL3523454 0.87 F10 (0.39) MAOAMAOBLMNAPTGS1SDHA
SCHEMBL3519194 0.86 F10 (0.36) MAOAMAOBLMNAPTGS1SDHA
SCHEMBL3519198 0.86 F10 (0.36) MAOAMAOBLMNAPTGS1SDHA
SCHEMBL3520796 0.85 F10 (0.35) MAOAMAOBLMNAPTGS1SDHA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7691889-B2 Antimycobacterial compounds LUPIN LIMITED (IN) 2010-04-06 US claimed
US-20050192275-A1 Novel antimycobacterial compounds LUPIN LIMITED (IN) 2005-09-01 US claimed
US-7691889-B2 Antimycobacterial compounds LUPIN LIMITED (IN) 2010-04-06 US disclosed
US-20050192275-A1 Novel antimycobacterial compounds LUPIN LIMITED (IN) 2005-09-01 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-20050192275-A1 Novel antimycobacterial compounds MDH1, IMMT, MLYCD ACKR3 3724/4885MAOA 2058/4885MAOB 2127/4885

“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.