SCHEMBL10074768

SCHEMBL10074768

COc1ccc(C(=O)O)c(Nc2ccc(-c3ccc(Nc4cc(OC)ccc4C(=O)O)c(OC)c3)cc2OC)c1

nearest known ligand 0.73

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 16/20 0.73
AKR1C2 P52895 16/20 0.73
KDM4E B2RXH2 2/20 0.71
APAF1 O14727 1/20 0.71
RECQL P46063 1/20 0.71
CASP6 P55212 1/20 0.71
CACNA1B Q00975 1/20 0.71
APBA1 Q02410 1/20 0.71
MCL1 Q07820 1/20 0.71
CASP8 Q14790 1/20 0.71
HSD17B1 P14061 1/20 0.54
HSD17B2 P37059 1/20 0.54
ALDH1A1 P00352 1/20 0.53
MAPT P10636 1/20 0.53
HPGD P15428 1/20 0.53

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
SCHEMBL4220700 0.84 AKR1C3 (0.74) AKR1C3AKR1C2KDM4EAPAF1RECQL
SCHEMBL11108122 0.84 AKR1C3 (0.72) AKR1C3AKR1C2MAPTHPGD
SCHEMBL23286069 0.83 KDM4E (0.83) AKR1C3AKR1C2KDM4EAPAF1RECQL
SCHEMBL29441241 0.83 KDM4E (1.00) AKR1C3AKR1C2KDM4EAPAF1RECQL
SCHEMBL1720516 0.83 KDM4E (1.00) AKR1C3AKR1C2KDM4EAPAF1RECQL
SCHEMBL8834053 0.82 AKR1C3 (0.63) AKR1C3AKR1C2KDM4EAPAF1RECQL
SCHEMBL4225580 0.79 AKR1C3 (0.60) AKR1C3AKR1C2KDM4EAPAF1RECQL
SCHEMBL9953672 0.79 KDM4E (0.72) AKR1C3AKR1C2KDM4EAPAF1RECQL
SCHEMBL9952764 0.78 KDM4E (0.67) AKR1C3AKR1C2KDM4EAPAF1RECQL
SCHEMBL11113166 0.78 AKR1C3 (0.79) AKR1C3AKR1C2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9351971-B2 Substituted 2,2′-biphenazines for treating diseases EUTROPICS PHARMACEUTICALS, INC. (US) 2016-05-31 US disclosed
US-9351971-B2 Substituted 2,2′-biphenazines for treating diseases EUTROPICS PHARMACEUTICALS, INC. (US) 2016-05-31 US disclosed
US-9351971-B2 Substituted 2,2′-biphenazines for treating diseases EUTROPICS PHARMACEUTICALS, INC. (US) 2016-05-31 US disclosed
US-20150216862-A1 2,2'-BIPHENAZINE COMPOUNDS AND METHODS USEFUL FOR TREATING DISEASES EUTROPICS THERAPEUTICS, INC. 2015-08-06 US disclosed
US-20150216862-A1 2,2'-BIPHENAZINE COMPOUNDS AND METHODS USEFUL FOR TREATING DISEASES EUTROPICS THERAPEUTICS, INC. 2015-08-06 US disclosed
US-20150216862-A1 2,2'-BIPHENAZINE COMPOUNDS AND METHODS USEFUL FOR TREATING DISEASES EUTROPICS THERAPEUTICS, INC. 2015-08-06 US disclosed
US-8987271-B2 2,2′-biphenazine compounds and methods useful for treating disease EUTROPICS PHARMACEUTICALS, INC. (US) 2015-03-24 US disclosed
US-8987271-B2 2,2′-biphenazine compounds and methods useful for treating disease EUTROPICS PHARMACEUTICALS, INC. (US) 2015-03-24 US disclosed
US-8987271-B2 2,2′-biphenazine compounds and methods useful for treating disease EUTROPICS PHARMACEUTICALS, INC. (US) 2015-03-24 US disclosed
US-20120225851-A1 COMPOSITIONS AND METHODS USEFUL FOR TREATING DISEASES EUTROPICS PHARMACEUTICALS, INC. (US) 2012-09-06 US disclosed
US-20120225851-A1 COMPOSITIONS AND METHODS USEFUL FOR TREATING DISEASES EUTROPICS PHARMACEUTICALS, INC. (US) 2012-09-06 US disclosed
US-20120225851-A1 COMPOSITIONS AND METHODS USEFUL FOR TREATING DISEASES EUTROPICS PHARMACEUTICALS, INC. (US) 2012-09-06 US disclosed
WO-2012088438-A1 COMPOSITIONS AND METHODS USEFUL FOR TREATING DISEASES EUTROPICS PHARMACEUTICALS, INC. (US) 2012-06-28 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-20120225851-A1 COMPOSITIONS AND METHODS USEFUL FOR TREATING DISEASES MCL1, BCL3, BCL9 AKR1C3 2669/4885AKR1C2 3430/4885KDM4E 1427/4885
US-20150216862-A1 2,2'-BIPHENAZINE COMPOUNDS AND METHODS USEFUL FOR TREATING DISEASES MCL1, BCL3, BCL2L1 AKR1C3 2216/4885AKR1C2 2590/4885KDM4E 709/4885

“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.