SCHEMBL3338504

SCHEMBL3338504

Nc1noc2ccc(C[C@H]3C(=O)N(C(=O)Nc4ccccc4)[C@@H]3C(=O)O)cc12

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TPSAB1 Q15661 5/20 0.47
TPSD1 Q9BZJ3 5/20 0.47
TPSG1 Q9NRR2 5/20 0.47
F11 P03951 6/20 0.40
F10 P00742 2/20 0.36
AURKB Q96GD4 2/20 0.35
AURKA O14965 1/20 0.35
HIF1A Q16665 1/20 0.35
NTRK1 P04629 1/20 0.35
KIT P10721 1/20 0.35
KDR P35968 1/20 0.35
FLT3 P36888 1/20 0.35
F2 P00734 1/20 0.34
PDCD1 Q15116 1/20 0.34
CD274 Q9NZQ7 1/20 0.34

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
SCHEMBL3336606 0.82 TPSAB1 (0.50) TPSAB1TPSD1TPSG1F11
SCHEMBL3334540 0.81 TPSAB1 (0.39) TPSAB1TPSD1TPSG1F11PDCD1
SCHEMBL3335679 0.79 TPSAB1 (0.48) TPSAB1TPSD1TPSG1F11
SCHEMBL4751699 0.78 F11 (0.62) TPSAB1TPSD1TPSG1F11
SCHEMBL13302756 0.78 F11 (0.62) TPSAB1TPSD1TPSG1F11
SCHEMBL3336016 0.75 FAAH (0.54) TPSAB1TPSD1TPSG1
SCHEMBL3335307 0.74 TPSAB1 (0.54) TPSAB1TPSD1TPSG1F11
Trifluoroacetic Acid SCHEMBL3330678 0.74 F11 (0.56) TPSAB1TPSD1TPSG1F11
Trifluoroacetic Acid SCHEMBL3334678 0.74 F11 (0.56) TPSAB1TPSD1TPSG1F11
SCHEMBL13302751 0.67 F11 (0.43) TPSAB1TPSD1TPSG1F11

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-20100144698-A1 SUBSTITUTED AZETIDINONES DAIAMED (US) 2010-06-10 US disclosed
US-20090143351-A1 SUBSTITUTED AZETIDINONES DAIAMED (US) 2009-06-04 US disclosed
US-7501404-B2 Substituted azetidinones DAIMED (US) 2009-03-10 US disclosed
US-20070105832-A1 Substituted azetidinones Cadrenal Therapeutics, Inc. 2007-05-10 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 (3 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-20070105832-A1 Substituted azetidinones F2R, CPA3, CFD TPSAB1 14/4885TPSD1 24/4885TPSG1 30/4885
US-20100144698-A1 SUBSTITUTED AZETIDINONES F2R, CPA3, CFD TPSAB1 14/4885TPSD1 24/4885TPSG1 30/4885
US-20090143351-A1 SUBSTITUTED AZETIDINONES F2R, CPA3, CFD TPSAB1 14/4885TPSD1 24/4885TPSG1 30/4885

“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.