SCHEMBL1407322

SCHEMBL1407322

COc1ccc(C(=O)c2cccc(C(F)(F)F)c2F)cc1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.52
MAPT P10636 4/20 0.50
MAOB P27338 2/20 0.50
MEN1 O00255 2/20 0.50
LMNA P02545 2/20 0.50
RAB9A P51151 3/20 0.47
NPC1 O15118 2/20 0.47
NPSR1 Q6W5P4 3/20 0.44
HTT P42858 1/20 0.44
MAPK1 P28482 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44
HPGD P15428 1/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
TP53 P04637 1/20 0.44
ALDH1A1 P00352 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
EPHX2 P34913 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
SCHEMBL7479627 0.87 KMT2A (0.60) KMT2AMAPTMAOBMEN1LMNA
SCHEMBL1124561 0.86 MAOB (0.54) KMT2AMAPTMAOBMEN1LMNA
SCHEMBL1125076 0.86 MAOB (0.46) KMT2AMAPTMAOBMEN1LMNA
SCHEMBL1408466 0.84 LMNA (0.45) KMT2AMAPTMAOBMEN1LMNA
SCHEMBL1407421 0.83 HDAC8 (0.45) LMNASMN1; SMN2HDAC8
SCHEMBL1407395 0.82 KMT2A (0.58) KMT2AMAPTMAOBMEN1LMNA
SCHEMBL29941229 0.82 KAT6A (0.52) MAPTLMNASMN1; SMN2ALDH1A1HDAC8
SCHEMBL1125117 0.82 KAT6A (0.52) MAPTLMNASMN1; SMN2ALDH1A1HDAC8
SCHEMBL1407535 0.81 NPC1 (0.52) KMT2AMAPTMEN1LMNARAB9A
SCHEMBL1407369 0.81 KMT2A (0.56) KMT2AMAPTMEN1LMNARAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2295429-A1 3-((hetero)aryl)-indazoles as Liver X receptor (LXR) and Th-1 inhibitors for the treatment of cardiovascular diseases Wyeth LLC (US) 2011-03-16 EP disclosed
US-7592363-B2 Indazoles WYETH (US) 2009-09-22 US disclosed
EP-1542976-B1 SUBSTITUTED 4-(INDAZOL-3-YL)PHENOLS AS ESTROGEN RECEPTOR (ER) LIGANDS AND THEIR USE IN THE TREATMENT OF INFLAMMATORY DISEASES WYETH CORP (US) 2009-02-04 EP disclosed
US-20070225349-A1 Substituted 4-(Indazol-3-yl)phenols WYETH (US) 2007-09-27 US disclosed
US-7241791-B2 Substituted 4-(indazol-3-yl)phenols WYETH (US) 2007-07-10 US disclosed
EP-1773781-A2 INDAZOLES USEFUL IN TREATING CARDIOVASCULAR DISEASES Wyeth (US) 2007-04-18 EP disclosed
WO-2006017384-A2 INDAZOLES USEFUL IN TREATING CARDIOVASCULAR DISEASES WYETH (US) 2006-02-16 WO disclosed
US-20060030612-A1 Indazoles useful in treating cardiovascular diseases WYETH (US) 2006-02-09 US disclosed
EP-1542976-A1 SUBSTITUTED 4-(INDAZOL-3-YL)PHENOLS AS ESTROGEN RECEPTOR (ER) LIGANDS AND THEIR USE IN THE TREATMENT OF INFLAMMATORY DISEASES Wyeth (US) 2005-06-22 EP disclosed
US-20040167127-A1 Substituted 4-(indazol-3-yl)phenols WYETH (US) 2004-08-26 US disclosed
WO-2004031159-A1 SUBSTITUTED 4-(INDAZOL-3-YL)PHENOLS AS ESTROGEN RECEPTOR (ER) LIGANDS AND THEIR USE IN THE TREATMENT OF INFLAMMATORY DISEASES WYETH (US) 2004-04-15 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-20060030612-A1 Indazoles useful in treating cardiovascular diseases NR1H2, NR1H3, CYP46A1 KMT2A 2373/4885MAPT 4377/4885MAOB 2206/4885
US-20070225349-A1 Substituted 4-(Indazol-3-yl)phenols INSR, TNNI3, INSRR KMT2A 2656/4885MAPT 4276/4885MAOB 3301/4885
US-20040167127-A1 Substituted 4-(indazol-3-yl)phenols INSR, MSR1, TNNI3 KMT2A 2418/4885MAPT 4325/4885MAOB 4011/4885

“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.