SCHEMBL6142887

SCHEMBL6142887

CC(C)(C)C(=O)Oc1ccc2c(c1)OCC(c1ccccc1)C2=O

nearest known ligand 0.68

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 16/20 0.68
ALOX15 P16050 1/20 0.48
ALOX12 P18054 1/20 0.48
KCNH2 Q12809 1/20 0.47
TRPV1 Q8NER1 1/20 0.47
MEN1 O00255 1/20 0.46
MAPT P10636 1/20 0.46
KMT2A Q03164 1/20 0.46
HSD17B10 Q99714 1/20 0.46
ADRA2A P08913 1/20 0.45
ADRA2C P18825 1/20 0.45
SLC6A4 P31645 1/20 0.45

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
SCHEMBL6143062 0.90 CYP19A1 (0.63) CYP19A1ALOX15ALOX12KCNH2TRPV1
SCHEMBL6142614 0.83 CYP19A1 (0.49) CYP19A1ALOX15ALOX12
SCHEMBL242978 0.79 CYP19A1 (0.61) CYP19A1ALOX15ALOX12KCNH2TRPV1
SCHEMBL2070571 0.79 CYP19A1 (0.61) CYP19A1ALOX15ALOX12KCNH2TRPV1
SCHEMBL6142591 0.77 ALOX12 (0.49) CYP19A1ALOX15ALOX12KCNH2TRPV1
SCHEMBL22339915 0.77 CYP19A1 (0.60) CYP19A1ALOX15ALOX12KCNH2TRPV1
SCHEMBL19410272 0.77 CYP19A1 (0.62) CYP19A1ALOX15ALOX12KCNH2TRPV1
SCHEMBL10685626 0.77 CYP19A1 (0.69) CYP19A1ALOX15ALOX12
SCHEMBL30251185 0.77 CYP19A1 (0.69) CYP19A1ALOX15ALOX12
SCHEMBL4432673 0.75 CYP19A1 (0.56) CYP19A1ALOX15ALOX12KCNH2TRPV1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6951883-B2 2H-1-benzopyran derivatives processes for their preparation and pharmaceutical compositions thereof CHIESI FARMACEUTICI S.P.A. (IT) 2005-10-04 US disclosed
EP-1355906-B1 2H-1-BENZOPYRAN DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS THEREOF CHIESI FARMA SPA (IT) 2005-01-12 EP disclosed
US-20040106595-A1 2H-1-benzopyran derivatives processes for their preparation and pharmaceutical compositions thereof CHIESI FARMACEUTICI S.P.A. (IT) 2004-06-03 US disclosed
EP-1355906-A1 2H-1-BENZOPYRAN DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS THEREOF CHIESI FARMACEUTICI S.p.A. (IT) 2003-10-29 EP disclosed
EP-1229036-A1 2H-1-benzopyran derivatives, processes for their preparation and pharmaceutical compositions thereof CHIESI FARMACEUTICI S.p.A. (IT) 2002-08-07 EP disclosed
WO-2002059113-A1 2H-1-BENZOPYRAN DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS THEREOF CHIESI FARMACEUTICI S.P.A. (IT) 2002-08-01 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-20040106595-A1 2H-1-benzopyran derivatives processes for their preparation and pharmaceutical compositions thereof CYP19A1, BRCA1, HPD CYP19A1 1/4885ALOX15 420/4885ALOX12 443/4885

“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.