SCHEMBL4871566

SCHEMBL4871566

CCCn1c(-c2ccc(C(O)(C(F)(F)F)C(F)(F)F)cc2)nc(-c2ccccc2)c1C(=O)NC(C)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MLYCD O95822 7/20 0.42
EGLN1 Q9GZT9 1/20 0.39
NR1H2 P55055 2/20 0.38
NR1H3 Q13133 2/20 0.38
PGR P06401 1/20 0.37
RORA P35398 1/20 0.37
RORC P51449 1/20 0.37
RORB Q92753 1/20 0.37
PTGER4 P35408 2/20 0.37
TRPV4 Q9HBA0 1/20 0.36
CKS1B P61024 1/20 0.36
SKP1 P63208 1/20 0.36
SKP2 Q13309 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
NR4A2 P43354 1/20 0.35

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
SCHEMBL4417912 0.85 EGLN1 (0.46) MLYCDEGLN1PGRRORARORC
SCHEMBL4430547 0.84 MLYCD (0.41) MLYCDNR1H2NR1H3PGRRORA
SCHEMBL4424179 0.79 MLYCD (0.39) MLYCDPGRRORARORCRORB
SCHEMBL4420347 0.79 MLYCD (0.41) MLYCDNR1H2NR1H3CKS1BSKP1
SCHEMBL4422948 0.78 MLYCD (0.43) MLYCDNR1H2NR1H3PGRRORA
SCHEMBL4422260 0.77 MLYCD (0.38) MLYCDCKS1BSKP1SKP2MEN1
SCHEMBL4424260 0.76 PLAU (0.41) EGLN1MEN1KMT2A
SCHEMBL4430579 0.75 TRPV4 (0.47) TRPV4
SCHEMBL4428901 0.74 MLYCD (0.42) MLYCDNR1H2NR1H3
SCHEMBL4430683 0.74 EGLN2 (0.40) MLYCDNR1H2NR1H3RORC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080070869-A1 Malonyl-CoA Decarboxylase Inhibitors Useful as Metabolic Modulators CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2008-03-20 US claimed
US-7279477-B2 Malonyl-CoA decarboxylase inhibitors useful as metabolic modulators CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2007-10-09 US claimed

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-20080070869-A1 Malonyl-CoA Decarboxylase Inhibitors Useful as Metabolic Modulators MLYCD, ME3, ACACA MLYCD 1/4885EGLN1 1863/4885NR1H2 1233/4885

“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.