SCHEMBL16993471

SCHEMBL16993471

O=C(c1ccc(O)c(F)c1)c1ccc(O)cc1O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.59
KMT2A Q03164 2/20 0.59
USP2 O75604 1/20 0.59
GAA P10253 1/20 0.59
KEAP1 Q14145 1/20 0.59
NFE2L2 Q16236 1/20 0.59
ALDH1A1 P00352 4/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
NPC1 O15118 1/20 0.55
TP53 P04637 1/20 0.55
MAPT P10636 1/20 0.55
HPGD P15428 1/20 0.55
ESR1 P03372 3/20 0.51
ESR2 Q92731 3/20 0.51
HSD17B1 P14061 2/20 0.51
HSD17B2 P37059 1/20 0.51
CES2 O00748 1/20 0.50
CA12 O43570 2/20 0.48
CA1 P00915 2/20 0.48
CA2 P00918 2/20 0.48

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
SCHEMBL29450505 0.84 MEN1 (0.65) MEN1KMT2AUSP2GAAKEAP1
SCHEMBL125785 0.84 MEN1 (0.65) MEN1KMT2AUSP2GAAKEAP1
SCHEMBL10735111 0.83 MEN1 (0.81) MEN1KMT2AUSP2GAAKEAP1
SCHEMBL10357074 0.82 MEN1 (0.68) MEN1KMT2AUSP2GAAKEAP1
SCHEMBL18241805 0.82 SNCA (0.47) ALDH1A1ESR1ESR2HSD17B1HSD17B2
SCHEMBL27927099 0.82 MEN1 (0.54) MEN1KMT2AUSP2GAAKEAP1
SCHEMBL93420 0.81 MEN1 (0.78) MEN1KMT2AUSP2GAAKEAP1
SCHEMBL29375096 0.81 MEN1 (0.78) MEN1KMT2AUSP2GAAKEAP1
SCHEMBL29748711 0.81 HSD17B1 (0.59) ESR1ESR2HSD17B1HSD17B2CES2
SCHEMBL27661242 0.81 HSD17B1 (0.59) ESR1ESR2HSD17B1HSD17B2CES2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10370349-B2 Functionalised benzopyran compounds and use thereof Kazia Therapeutics Limited (AU) 2019-08-06 US disclosed
US-20180141925-A1 FUNCTIONALISED BENZOPYRAN COMPOUNDS AND USE THEREOF Kazia Therapeutics Limited (AU) 2018-05-24 US disclosed
EP-2953938-B1 FUNCTIONALISED BENZOPYRAN COMPOUNDS AND USE THEREOF Novogen ltd (AU) 2017-08-02 EP disclosed
US-9701655-B2 Functionalised benzopyran compounds and use thereof NOVOGEN LIMITED (AU) 2017-07-11 US disclosed
US-20160340329-A1 FUNCTIONALISED BENZOPYRAN COMPOUNDS AND USE THEREOF VIVESTO AB (SE) 2016-11-24 US disclosed
EP-2953938-A1 FUNCTIONALISED BENZOPYRAN COMPOUNDS AND USE THEREOF Novogen Ltd. (AU) 2015-12-16 EP disclosed
WO-2015117202-A1 FUNCTIONALISED BENZOPYRAN COMPOUNDS AND USE THEREOF NOVOGEN LIMITED (AU) 2015-08-13 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 (3 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-20180141925-A1 FUNCTIONALISED BENZOPYRAN COMPOUNDS AND USE THEREOF BRCA1, BRAP, EP300 MEN1 7/4885KMT2A 1486/4885USP2 2117/4885
US-20160340329-A1 FUNCTIONALISED BENZOPYRAN COMPOUNDS AND USE THEREOF BRCA1, VHL, NQO1 MEN1 2754/4885KMT2A 539/4885USP2 3699/4885
US-10370349-B2 Functionalised benzopyran compounds and use thereof BRCA1, BRAP, EP300 MEN1 7/4885KMT2A 1486/4885USP2 2117/4885

“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.