SCHEMBL5254396

SCHEMBL5254396

CC(=O)C(C(=O)O)c1c(F)cccc1Cl

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.39
RIPK1 Q13546 1/20 0.39
ITGB2 P05107 1/20 0.39
ICAM1 P05362 1/20 0.39
ITGAL P20701 1/20 0.39
KDM4E B2RXH2 1/20 0.39
CES2 O00748 1/20 0.39
CES1 P23141 1/20 0.39
GAA P10253 2/20 0.36
ALDH1A1 P00352 2/20 0.36
HPGD P15428 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
TP53 P04637 1/20 0.35
KMT2A Q03164 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
SCHEMBL5255790 0.90 CES2 (0.43) RIPK1ITGB2ICAM1ITGALKDM4E
SCHEMBL7683035 0.88 CES2 (0.44) ITGB2ICAM1ITGALCES2CES1
SCHEMBL2836425 0.80 KMT2A (0.47) KDM4EGAAALDH1A1L3MBTL1KMT2A
SCHEMBL5251229 0.80 KMT2A (0.50) KDM4EGAAALDH1A1HPGDL3MBTL1
SCHEMBL11139560 0.79 CXCL8 (0.45) RIPK1ITGB2ICAM1ITGALKDM4E
SCHEMBL28852475 0.79 CES2 (0.41) RIPK1ITGB2ICAM1ITGALKDM4E
SCHEMBL14491194 0.78 ALDH1A1 (0.43) MAPK1KDM4ECES2CES1GAA
SCHEMBL7676477 0.78 AKR1C3 (0.41) CES2CES1
SCHEMBL23301921 0.77 CES2 (0.50) MAPK1RIPK1ITGB2ICAM1ITGAL
SCHEMBL29723941 0.77 CES2 (0.50) MAPK1RIPK1ITGB2ICAM1ITGAL

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
EP-1431299-B1 IMIDAZO(1,2-a)PYRIMIDINES AND FUNGICIDE COMPOSITIONS CONTAINING THE SAME SUMITOMO CHEMICAL CO (JP) 2007-05-23 EP disclosed
US-7211545-B2 Imidazo[1,2-a]pyrimidine and fungicidal compositions containing thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-05-01 US disclosed
US-20040235865-A1 Imidazo[1,2-a]pyrimidine and fungicidal compositions containing thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-11-25 US disclosed
EP-1431299-A1 IMIDAZO(1,2-a)PYRIMIDINES AND FUNGICIDE COMPOSITIONS CONTAINING THE SAME Sumitomo Chemical Company, Limited (JP) 2004-06-23 EP 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-20040235865-A1 Imidazo[1,2-a]pyrimidine and fungicidal compositions containing thereof CBR1, NAT1, CBR3 MAPK1 2051/4885RIPK1 2971/4885ITGB2 4470/4885

“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.