SCHEMBL6239688

SCHEMBL6239688

CC(=O)NCC1CN(c2ccc3c(c2)-c2[nH]nc(-c4cccc(OC(F)(F)F)c4)c2CCC3)C(=O)O1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 2/20 0.47
MAOA P21397 5/20 0.42
MAOB P27338 2/20 0.41
PTGS1 P23219 2/20 0.41
SDHA P31040 2/20 0.41
LMNA P02545 1/20 0.41
CALML3 P27482 1/20 0.41
CMA1 P23946 2/20 0.37
PIM1 P11309 1/20 0.36
PIM2 Q9P1W9 1/20 0.36
RORC P51449 1/20 0.36

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
SCHEMBL6239683 1.00 ENPP2 (0.47) ENPP2MAOAMAOBPTGS1SDHA
SCHEMBL6238457 0.95 ENPP2 (0.47) ENPP2MAOAMAOBPTGS1SDHA
SCHEMBL6238466 0.95 ENPP2 (0.47) ENPP2MAOAMAOBPTGS1SDHA
SCHEMBL6237003 0.92 MAOA (0.44) ENPP2MAOAMAOBPTGS1SDHA
SCHEMBL6236996 0.92 MAOA (0.44) ENPP2MAOAMAOBPTGS1SDHA
SCHEMBL6241236 0.92 MAOA (0.42) ENPP2MAOAMAOBPTGS1SDHA
SCHEMBL6241227 0.92 MAOA (0.42) ENPP2MAOAMAOBPTGS1SDHA
SCHEMBL6236918 0.90 MAOA (0.44) ENPP2MAOAMAOBPTGS1SDHA
SCHEMBL6236917 0.90 MAOA (0.44) ENPP2MAOAMAOBPTGS1SDHA
SCHEMBL6240792 0.89 MAOA (0.47) MAOAMAOBPTGS1SDHALMNA

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-20050288273-A1 Antibacterial agents BOYER FREDERICK E JR 2005-12-29 US claimed
EP-1594865-A2 ANTIBACTERIAL AGENTS Warner-Lambert Company LLC (US) 2005-11-16 EP claimed
WO-2004069832-A2 ANTIBACTERIAL AGENTS WARNER-LAMBERT COMPANY LLC (US) 2004-08-19 WO claimed
US-20050288273-A1 Antibacterial agents BOYER FREDERICK E JR 2005-12-29 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-20050288273-A1 Antibacterial agents MRPL21, RPN2, FBL ENPP2 1914/4885MAOA 236/4885MAOB 221/4885

“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.