SCHEMBL1134433

SCHEMBL1134433

O=Cc1ccc(Cc2ccccc2)cc1O

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDH1 O75874 1/20 0.63
HNF4A P41235 1/20 0.54
MPO P05164 1/20 0.53
TRIM24 O15164 2/20 0.50
TRIM33 Q9UPN9 2/20 0.50
BCL2 P10415 1/20 0.47
BCL2L1 Q07817 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA4 P22748 1/20 0.47
CA6 P23280 1/20 0.47
TYR P14679 2/20 0.44
CALM1 P0DP23 1/20 0.44
ACMSD Q8TDX5 1/20 0.44
POLB P06746 1/20 0.43
MAPT P10636 1/20 0.43
CDK1 P06493 1/20 0.43
PLA2G10 O15496 1/20 0.43
PLA2G2A P14555 1/20 0.43
LMNA P02545 1/20 0.43

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
SCHEMBL21001943 0.92 CA1 (0.54) IDH1HNF4AMPOTRIM24TRIM33
SCHEMBL21001935 0.88 IDH1 (0.49) IDH1HNF4AMPOTRIM24TRIM33
SCHEMBL10331745 0.87 ESR1 (0.54) IDH1TRIM24TRIM33CA1CA2
SCHEMBL10331741 0.87 CA1 (0.65) IDH1TRIM24TRIM33CA1CA2
SCHEMBL11457521 0.85 IDH1 (0.63) IDH1HNF4AMPOTRIM24TRIM33
SCHEMBL10955136 0.82 TBXAS1 (0.51) IDH1
Diphenylmethane SCHEMBL28072548 0.82 TRIM24 (0.75) IDH1HNF4ATRIM24TRIM33BCL2
SCHEMBL21002110 0.80 CDK1 (0.58) TRIM24TRIM33TYRMAPTCDK1
SCHEMBL28422538 0.80 TYR (0.70) TRIM24TRIM33TYRCALM1LMNA
SCHEMBL2735986 0.79 TYR (0.48) TRIM24TRIM33TYRPOLBMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111233908-A Benzoxaborol-1-ol compound and preparation method and application thereof 南京农业大学 2020-06-05 CN disclosed
EP-2285384-A2 BORON-CONTAINING SMALL MOLECULES Anacor Pharmaceuticals, Inc. (US) 2011-02-23 EP disclosed
US-20100256092-A1 BORON-CONTAINING SMALL MOLECULES ANACOR PHARMACEUTICALS, INC. (US) 2010-10-07 US disclosed
US-20100256092-A1 BORON-CONTAINING SMALL MOLECULES ANACOR PHARMACEUTICALS, INC. (US) 2010-10-07 US disclosed
US-20100256092-A1 BORON-CONTAINING SMALL MOLECULES ANACOR PHARMACEUTICALS, INC. (US) 2010-10-07 US disclosed
WO-2009140309-A2 BORON-CONTAINING SMALL MOLECULES ANACOR PHARMACEUTICALS, INC. (US) 2009-11-19 WO disclosed
WO-2009140309-A2 BORON-CONTAINING SMALL MOLECULES ANACOR PHARMACEUTICALS, INC. (US) 2009-11-19 WO disclosed
US-4074007-A Coating composition HOECHST AKTIENGESELLSCHAFT (DT) 1978-02-14 US disclosed
US-3969290-A POLYMERS FROM OXAMIDIC ESTERS, POLYISOCYANATES, AND POLYBASIC CARBOXYLIC ACIDS HOECHST AKTIENGESELLSCHAFT (DT) 1976-07-13 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-20100256092-A1 BORON-CONTAINING SMALL MOLECULES BCL6B, BCL6, BTD IDH1 3919/4885HNF4A 1600/4885MPO 662/4885

“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.