SCHEMBL2071246

SCHEMBL2071246

COc1ccc(C2Cc3ccc(O)c(C)c3OC2=O)cc1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RECQL P46063 2/20 0.49
KMT2A Q03164 2/20 0.49
POLB P06746 2/20 0.49
ALOX15 P16050 3/20 0.48
ALOX12 P18054 3/20 0.48
ALDH1A1 P00352 6/20 0.46
HPGD P15428 2/20 0.41
MEN1 O00255 1/20 0.41
MAPT P10636 1/20 0.41
CYP1A1 P04798 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP1B1 Q16678 1/20 0.38

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
SCHEMBL28767834 0.84 POLB (0.43) POLBMAPT
SCHEMBL12375675 0.80 RECQL (0.46) RECQLKMT2APOLBALOX15ALOX12
SCHEMBL3357789 0.77 ALOX15 (0.57) RECQLKMT2APOLBALOX15ALOX12
SCHEMBL11263779 0.76 ALDH1A1 (0.64) RECQLKMT2APOLBALDH1A1HPGD
SCHEMBL2069508 0.76 ALDH1A1 (0.59) RECQLKMT2APOLBALOX15ALOX12
SCHEMBL12408640 0.75 RECQL (0.45) RECQLKMT2APOLBALOX15ALOX12
SCHEMBL10561913 0.74 ALOX15 (0.79) RECQLKMT2APOLBALOX15ALOX12
SCHEMBL17938826 0.73 ALOX12 (0.42) RECQLKMT2APOLBALOX15ALOX12
SCHEMBL12621483 0.73 RECQL (0.38) RECQLKMT2APOLBALOX15ALOX12
SCHEMBL2071244 0.72 ALOX12 (0.64) RECQLKMT2APOLBALOX15ALOX12

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-7906660-B2 Production of isoflavone derivatives NOVOGEN RESEARCH PTY LTD (AU) 2011-03-15 US disclosed
US-20060217564-A1 Production of isoflavone derivatives NOVOGEN RESEARCH PTY LTD. 2006-09-28 US disclosed
US-20050143588-A1 Production of isoflavone derivatives NOVOGEN RESEARCH PTY LTD. 2005-06-30 US disclosed
EP-1153020-A4 PRODUCTION OF ISOFLAVONE DERIVATIVES NOVOGEN RES PTY LTD (AU) 2002-08-21 EP disclosed
EP-1153020-A1 PRODUCTION OF ISOFLAVONE DERIVATIVES Novogen Research Pty. Ltd. (AU) 2001-11-14 EP disclosed
WO-2000049009-A1 PRODUCTION OF ISOFLAVONE DERIVATIVES NOVOGEN RESEARCH PTY. LTD. (AU) 2000-08-24 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 (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-20060217564-A1 Production of isoflavone derivatives CYP51A1, EGLN2, EGLN3 RECQL 4264/4885KMT2A 2984/4885POLB 3777/4885
US-20050143588-A1 Production of isoflavone derivatives CYP51A1, EGLN2, EGLN3 RECQL 4264/4885KMT2A 2984/4885POLB 3777/4885

“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.