SCHEMBL12377309

SCHEMBL12377309

CC(C)n1c(NC(=O)C(N)Cc2ccc(-c3ccccc3)cc2)nc2cc(C(F)(F)F)ccc21

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PRCP P42785 1/20 0.43
MAP3K7 O43318 1/20 0.41
IRAK1 P51617 1/20 0.41
IRAK4 Q9NWZ3 1/20 0.41
SLC1A3 P43003 3/20 0.41
SLC1A2 P43004 3/20 0.41
SLC1A1 P43005 3/20 0.41
TPH1 P17752 3/20 0.41
PPARG P37231 4/20 0.40
RORC P51449 1/20 0.39
CDK2 P24941 1/20 0.38
ACP3 P15309 1/20 0.38
MCL1 Q07820 1/20 0.37
DHODH Q02127 1/20 0.37
GRB2 P62993 1/20 0.37
HDAC6 Q9UBN7 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
SCHEMBL12413905 0.91 PRCP (0.42) PRCPMAP3K7IRAK1IRAK4SLC1A3
SCHEMBL12377301 0.86 PPARG (0.39) MAP3K7IRAK1IRAK4SLC1A3SLC1A2
SCHEMBL12377303 0.85 PRCP (0.47) PRCPSLC1A3SLC1A2SLC1A1TPH1
SCHEMBL12377294 0.82 SLC1A3 (0.45) MAP3K7IRAK1IRAK4SLC1A3SLC1A2
SCHEMBL14641727 0.80 SLC1A3 (0.42) SLC1A3SLC1A2SLC1A1DHODHHDAC6
SCHEMBL12377324 0.80 MAPT (0.52) RORC
SCHEMBL12377299 0.73 MAPT (0.53) HDAC6
SCHEMBL12413915 0.72 SLC1A3 (0.44) SLC1A3SLC1A2SLC1A1DHODHHDAC6
SCHEMBL5087662 0.71 NPC1 (0.51) IRAK4RORC
SCHEMBL12377293 0.71 PRCP (0.38) PRCPSLC1A3SLC1A2SLC1A1

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-7989422-B2 Antibacterial agents ALCHEMIA LIMITED (AU) 2011-08-02 US disclosed
US-20090023669-A1 Antibacterial Agents ALCHEMIA LIMITED (AU) 2009-01-22 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-20090023669-A1 Antibacterial Agents MRPL21, FUT6, FUT5 PRCP 1394/4885MAP3K7 2402/4885IRAK1 983/4885

“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.