SCHEMBL7155199

SCHEMBL7155199

COc1ccc2c(-c3ccccc3)c(-c3ccc(Br)cc3)c(=O)oc2c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.58
CYP1A2 P05177 1/20 0.58
CYP2C9 P11712 1/20 0.58
CYP2C19 P33261 1/20 0.58
CA1 P00915 2/20 0.57
CA2 P00918 2/20 0.57
CYP19A1 P11511 5/20 0.56
KDM4E B2RXH2 5/20 0.56
MAPT P10636 3/20 0.56
LMNA P02545 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
TNKS O95271 1/20 0.55
KMT2A Q03164 2/20 0.52
CYP3A4 P08684 2/20 0.52
HPGD P15428 2/20 0.52
HSD17B10 Q99714 2/20 0.52
MEN1 O00255 1/20 0.52
THRB P10828 1/20 0.52
NPC1 O15118 5/20 0.51
RAB9A P51151 4/20 0.51

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
SCHEMBL7117813 0.92 ALDH1A1 (0.64) ALDH1A1CYP1A2CYP2C9CYP2C19CA1
SCHEMBL7117556 0.92 ALDH1A1 (0.67) ALDH1A1CYP1A2CYP2C9CYP2C19CA1
SCHEMBL13819275 0.89 ALDH1A1 (0.63) ALDH1A1CYP1A2CYP2C9CYP2C19CA1
SCHEMBL14389075 0.88 ALDH1A1 (0.58) ALDH1A1CYP1A2CYP2C9CYP2C19CA1
SCHEMBL8934549 0.88 CA1 (0.64) ALDH1A1CYP1A2CYP2C9CYP2C19CA1
SCHEMBL7120550 0.88 CYP19A1 (0.72) ALDH1A1CYP1A2CYP2C9CYP2C19CA1
SCHEMBL15103561 0.87 CA1 (0.63) ALDH1A1CYP1A2CYP2C9CYP2C19CA1
SCHEMBL30493806 0.85 CA1 (0.61) ALDH1A1CYP1A2CYP2C9CYP2C19CA1
SCHEMBL7115028 0.85 NPC1 (0.69) ALDH1A1CYP1A2CYP2C9CYP2C19CA1
SCHEMBL7019582 0.84 KDM4E (0.60) ALDH1A1CYP1A2CYP2C9CYP2C19CA1

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2003504327-A 2003-02-04 JP claimed
EP-1223928-A2 USE OF FLAVONES, COUMARINS AND RELATED COMPOUNDS TO TREAT INFECTIONS Prendergast, Patrick Thomas (IE) 2002-07-24 EP claimed
WO-2001003681-A2 USE OF FLAVONES, COUMARINS AND RELATED COMPOUNDS TO TREAT INFECTIONS PRENDERGAST PATRICK T (IE) 2001-01-18 WO claimed
US-RE46558-E1 Compositions and methods to treat diseases characterized by cellular proliferation and angiogenesis PALOMA PHARMACEUTICALS, INC. (US) 2017-09-26 US disclosed
US-RE46558-E1 Compositions and methods to treat diseases characterized by cellular proliferation and angiogenesis PALOMA PHARMACEUTICALS, INC. (US) 2017-09-26 US disclosed
US-9381187-B2 Radiation countermeasure agents PALOMA PHARMACEUTICALS, INC. (US) 2016-07-05 US disclosed
US-9381187-B2 Radiation countermeasure agents PALOMA PHARMACEUTICALS, INC. (US) 2016-07-05 US disclosed
US-20140221471-A1 COMPOSITIONS AND METHODS TO TREAT SKIN DISEASES CHARACTERIZED BY CELLULAR PROLIFERATION AND ANGIOGENESIS PALOMA PHARMACEUTICALS, INC. 2014-08-07 US disclosed
US-20140221471-A1 COMPOSITIONS AND METHODS TO TREAT SKIN DISEASES CHARACTERIZED BY CELLULAR PROLIFERATION AND ANGIOGENESIS PALOMA PHARMACEUTICALS, INC. 2014-08-07 US disclosed
US-20140105920-A1 COMPOSITIONS AND METHODS TO TREAT DISEASE CHARACTERIZED BY CELLULAR PROLIFERATION AND ANGIOGENESIS PALOMA PHARMACEUTICALS INC (US) 2014-04-17 US disclosed
US-20140105920-A1 COMPOSITIONS AND METHODS TO TREAT DISEASE CHARACTERIZED BY CELLULAR PROLIFERATION AND ANGIOGENESIS PALOMA PHARMACEUTICALS INC (US) 2014-04-17 US disclosed
US-20110021618-A1 METHODS OF TREATING FIBROTIC DISORDERS PALOMA PHARMACEUTICALS, INC. (US) 2011-01-27 US disclosed
US-20110021618-A1 METHODS OF TREATING FIBROTIC DISORDERS PALOMA PHARMACEUTICALS, INC. (US) 2011-01-27 US disclosed
US-20070197567-A1 COMPOSITIONS AND METHODS TO TREAT DISEASES CHARACTERIZED BY CELLULAR PROLIFERATION AND ANGIOGENESIS PALOMA PHARMACEUTICALS, INC. (US) 2007-08-23 US disclosed
US-20070197567-A1 COMPOSITIONS AND METHODS TO TREAT DISEASES CHARACTERIZED BY CELLULAR PROLIFERATION AND ANGIOGENESIS PALOMA PHARMACEUTICALS, INC. (US) 2007-08-23 US disclosed
US-20060257337-A1 Compositions and methods to treat skin diseases characterized by cellular proliferation and angiogenesis PALOMA PHARMACEUTICALS, INC. 2006-11-16 US disclosed
US-20060257337-A1 Compositions and methods to treat skin diseases characterized by cellular proliferation and angiogenesis PALOMA PHARMACEUTICALS, INC. 2006-11-16 US disclosed
US-6555523-B1 Such as 3',4'-diacetoxy-5,6,7-trimethoxyflavone or naringin in the treatment HIV, picornavirus, and/or respiratory virus CASCADE ESTATES LTD. (MU) 2003-04-29 US disclosed
EP-1223928-A2 USE OF FLAVONES, COUMARINS AND RELATED COMPOUNDS TO TREAT INFECTIONS Prendergast, Patrick Thomas (IE) 2002-07-24 EP disclosed
WO-2001003681-A2 USE OF FLAVONES, COUMARINS AND RELATED COMPOUNDS TO TREAT INFECTIONS PRENDERGAST PATRICK T (IE) 2001-01-18 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 (5 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-20140221471-A1 COMPOSITIONS AND METHODS TO TREAT SKIN DISEASES CHARACTERIZED BY CELLULAR PROLIFERATION AND ANGIOGENESIS MKI67, VEGFA, TYR ALDH1A1 2351/4885CYP1A2 606/4885CYP2C9 3182/4885
US-20140105920-A1 COMPOSITIONS AND METHODS TO TREAT DISEASE CHARACTERIZED BY CELLULAR PROLIFERATION AND ANGIOGENESIS MKI67, VEGFA, FLT1 ALDH1A1 1226/4885CYP1A2 3476/4885CYP2C9 4736/4885
US-20110021618-A1 METHODS OF TREATING FIBROTIC DISORDERS COL2A1, MMP1, COL1A1 ALDH1A1 494/4885CYP1A2 3402/4885CYP2C9 4824/4885
US-20070197567-A1 COMPOSITIONS AND METHODS TO TREAT DISEASES CHARACTERIZED BY CELLULAR PROLIFERATION AND ANGIOGENESIS MKI67, VEGFA, HDGF ALDH1A1 1225/4885CYP1A2 2765/4885CYP2C9 4560/4885
US-20060257337-A1 Compositions and methods to treat skin diseases characterized by cellular proliferation and angiogenesis MKI67, VEGFA, TYR ALDH1A1 2351/4885CYP1A2 606/4885CYP2C9 3182/4885

“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.