SCHEMBL12413877

SCHEMBL12413877

CNS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
MEP1B Q16820 1/20 0.58
CCR2 P41597 9/20 0.58
TSHR P16473 2/20 0.56
KIF11 P52732 1/20 0.55
VCAM1 P19320 1/20 0.54
ALDH1A1 P00352 1/20 0.53
LMNA P02545 1/20 0.53
MAPK1 P28482 1/20 0.51
TP53 P04637 1/20 0.51
MAPT P10636 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.50

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
SCHEMBL12377255 0.83 ALDH1A1 (0.58) POLBL3MBTL1MEP1BCCR2TSHR
SCHEMBL6832021 0.83 POLB (0.62) POLBL3MBTL1MEP1BCCR2TSHR
SCHEMBL172392 0.81 CCR2 (0.58) POLBL3MBTL1MEP1BCCR2TSHR
SCHEMBL10804574 0.81 MAPT (0.69) MEP1BCCR2TSHRTP53MAPT
SCHEMBL27790847 0.81 MEP1B (0.71) POLBL3MBTL1MEP1BCCR2TSHR
SCHEMBL6209362 0.80 MEP1B (0.54) POLBL3MBTL1MEP1BCCR2TSHR
SCHEMBL2371885 0.80 KIF11 (0.55) POLBL3MBTL1MEP1BKIF11VCAM1
SCHEMBL11697492 0.80 FFAR4 (0.57) L3MBTL1KIF11ALDH1A1LMNASMN1; SMN2
SCHEMBL18714236 0.79 POLB (0.73) POLBL3MBTL1MEP1BCCR2TSHR
SCHEMBL127681 0.79 MEP1B (0.52) POLBL3MBTL1MEP1BCCR2TSHR

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 3 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
WO-2007070947-A1 ANTIBACTERIAL AGENTS ALCHEMIA LTD (AU) 2007-06-28 WO 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 POLB 3470/4885L3MBTL1 3195/4885MEP1B 2903/4885

“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.