SCHEMBL9890644

SCHEMBL9890644

O=C(O)Cc1ccccc1-c1cccc(F)c1F

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CXCL8 P10145 2/20 0.53
TDP1 Q9NUW8 1/20 0.51
AKR1B1 P15121 3/20 0.48
PTGS2 P35354 2/20 0.46
GRK6 P43250 1/20 0.46
LMNA P02545 1/20 0.43
RAB9A P51151 1/20 0.43
SUCNR1 Q9BXA5 1/20 0.43
PTGER1 P34995 1/20 0.43
PTGER4 P35408 1/20 0.43
PTGER3 P43115 1/20 0.43
PTGER2 P43116 1/20 0.43
PTGDR2 Q9Y5Y4 2/20 0.41

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
SCHEMBL538984 0.87 CXCL8 (0.57) CXCL8TDP1AKR1B1PTGS2LMNA
SCHEMBL2395880 0.85 ALDH1A1 (0.41) CXCL8GRK6LMNARAB9A
SCHEMBL723768 0.83 CXCL8 (0.56) CXCL8TDP1AKR1B1PTGS2
SCHEMBL7827157 0.83 AKR1B1 (0.67) CXCL8TDP1AKR1B1PTGS2LMNA
SCHEMBL28134586 0.82 CXCL8 (0.54) CXCL8TDP1AKR1B1PTGS2
SCHEMBL1154512 0.80 CXCL8 (0.47) CXCL8TDP1AKR1B1PTGS2LMNA
SCHEMBL29533621 0.79 CXCL8 (0.65) CXCL8TDP1AKR1B1PTGS2LMNA
SCHEMBL8645 0.79 CXCL8 (0.65) CXCL8TDP1AKR1B1PTGS2LMNA
SCHEMBL15866869 0.78 LMNA (0.38) GRK6LMNARAB9A
Fluoride SCHEMBL11183201 0.77 CXCL8 (0.62) CXCL8TDP1AKR1B1PTGS2LMNA

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120142771-A1 BIPHENYLACETAMIDE DERIVATIVE DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2012-06-07 US disclosed
US-20120142771-A1 BIPHENYLACETAMIDE DERIVATIVE DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2012-06-07 US disclosed
EP-2374790-A1 BIPHENYLACETAMIDE DERIVATIVE Dainippon Sumitomo Pharma Co., Ltd. (JP) 2011-10-12 EP disclosed
US-20110224304-A1 BIPHENYLACETAMIDE DERIVATIVE DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2011-09-15 US disclosed
US-20110224304-A1 BIPHENYLACETAMIDE DERIVATIVE DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2011-09-15 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 (2 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-20120142771-A1 BIPHENYLACETAMIDE DERIVATIVE HRH3, KCNH3, BRPF3 CXCL8 3300/4885TDP1 4273/4885AKR1B1 734/4885
US-20110224304-A1 BIPHENYLACETAMIDE DERIVATIVE HRH3, KCNH3, BRPF3 CXCL8 3300/4885TDP1 4273/4885AKR1B1 734/4885

“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.