SCHEMBL4635997

SCHEMBL4635997

CCOC(=O)Cc1c(C)c(Sc2ccc(S(C)(=O)=O)cc2)c2cc(C#N)ccn12

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
PTGDR2 Q9Y5Y4 3/20 0.37
CYP2C9 P11712 1/20 0.37
AKR1B1 P15121 1/20 0.37
ALOX15 P16050 1/20 0.36
ALDH1A1 P00352 1/20 0.36
PTGS2 P35354 2/20 0.34
PTGS1 P23219 1/20 0.34
HSP90AA1 P07900 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
SCHEMBL4635633 0.93 L3MBTL1 (0.40) L3MBTL1SMN1; SMN2LMNAMAPTALOX15
SCHEMBL4636937 0.90 L3MBTL1 (0.38) L3MBTL1SMN1; SMN2LMNAMAPTCYP2C9
SCHEMBL4635707 0.89 PTGDR2 (0.43) L3MBTL1LMNAPTGDR2CYP2C9AKR1B1
SCHEMBL4635990 0.87 L3MBTL1 (0.35) L3MBTL1SMN1; SMN2LMNAMAPTPTGDR2
SCHEMBL4635720 0.87 PTGS2 (0.39) L3MBTL1SMN1; SMN2PTGDR2ALOX15ALDH1A1
SCHEMBL4636272 0.87 L3MBTL1 (0.38) L3MBTL1SMN1; SMN2LMNAMAPTALOX15
SCHEMBL4636877 0.87 POLB (0.46) L3MBTL1SMN1; SMN2LMNAMAPTALDH1A1
SCHEMBL4635980 0.86 L3MBTL1 (0.40) L3MBTL1SMN1; SMN2LMNAMAPTPTGDR2
SCHEMBL4636153 0.86 L3MBTL1 (0.41) L3MBTL1SMN1; SMN2LMNAMAPTPTGDR2
SCHEMBL4636280 0.86 ALDH1A1 (0.45) L3MBTL1SMN1; SMN2LMNAMAPTALDH1A1

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-20080306109-A1 Indolizine Derivatives as Ligands of the Crth2 Receptor ARGENTA DISCOVERY LIMITED (GB) 2008-12-11 US disclosed
EP-1931663-A1 IMDOLIZINE DERIVATIVES AS LIGANDS OF THE CRTH2 RECEPTOR Argenta Discovery Limited (GB) 2008-06-18 EP disclosed
WO-2007031747-A1 IMDOLIZINE DERIVATIVES AS LIGANDS OF THE CRTH2 RECEPTOR ARGENTA DISCOVERY LIMITED (GB) 2007-03-22 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-20080306109-A1 Indolizine Derivatives as Ligands of the Crth2 Receptor HRH4, HRH2, HRH3 L3MBTL1 3929/4885SMN1; SMN2 4618/4885LMNA 4224/4885

“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.