SCHEMBL4432673

SCHEMBL4432673

CC(=O)Oc1ccc2c(c1)OCC(c1ccc(Br)cc1)C2=O

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 14/20 0.56
ALOX12 P18054 2/20 0.52
ALOX15 P16050 1/20 0.52
KCNH2 Q12809 1/20 0.50
TRPV1 Q8NER1 1/20 0.50
CYP3A4 P08684 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
LMNA P02545 1/20 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
SCHEMBL242978 0.93 CYP19A1 (0.61) CYP19A1ALOX12ALOX15KCNH2TRPV1
SCHEMBL2604717 0.84 CYP19A1 (0.64) CYP19A1ALOX12ALOX15KCNH2TRPV1
SCHEMBL2070571 0.84 CYP19A1 (0.61) CYP19A1ALOX12ALOX15KCNH2TRPV1
SCHEMBL19410272 0.81 CYP19A1 (0.62) CYP19A1ALOX12ALOX15KCNH2TRPV1
SCHEMBL19410273 0.78 CYP19A1 (0.55) CYP19A1ALOX12ALOX15KCNH2TRPV1
SCHEMBL3957591 0.77 ALOX12 (0.53) CYP19A1ALOX12ALOX15KCNH2TRPV1
SCHEMBL154220 0.77 ALOX12 (0.42) CYP19A1ALOX12ALOX15KCNH2TRPV1
SCHEMBL6143062 0.77 CYP19A1 (0.63) CYP19A1ALOX12ALOX15KCNH2TRPV1
SCHEMBL131535 0.77 ALOX12 (0.42) CYP19A1ALOX12ALOX15KCNH2TRPV1
SCHEMBL5503331 0.77 CYP19A1 (0.84) CYP19A1ALOX12ALOX15KCNH2TRPV1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090233999-A1 COMPOSITIONS AND THERAPEUTIC METHODS INVOLVING ISOFLAVONES AND ANALOGUES THEREOF NOVOGEN RESEARCH PTY LTD (AU) 2009-09-17 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 (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-20090233999-A1 COMPOSITIONS AND THERAPEUTIC METHODS INVOLVING ISOFLAVONES AND ANALOGUES THEREOF SHBG, OAT, APOB CYP19A1 16/4885ALOX12 1633/4885ALOX15 1586/4885

“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.