SCHEMBL6443549

SCHEMBL6443549

CC(=CO)C(=O)Oc1ccc(C(C)(C)c2ccc(OC(=O)C(C)=CO)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ELANE P08246 5/20 0.39
AR P10275 2/20 0.38
ESR1 P03372 1/20 0.38
CYP3A4 P08684 1/20 0.38
HPGD P15428 1/20 0.38
TSHR P16473 1/20 0.38
SLC6A2 P23975 1/20 0.38
SLC6A4 P31645 1/20 0.38
HTR6 P50406 1/20 0.38
ESRRG P62508 1/20 0.38
SLC6A3 Q01959 1/20 0.38
ESR2 Q92731 1/20 0.38
HSD17B10 Q99714 1/20 0.38
RAB9A P51151 3/20 0.37
HTT P42858 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
NPC1 O15118 1/20 0.37

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
SCHEMBL934478 0.83 ESR1 (0.50) MAPTTDP1L3MBTL1ELANEAR
SCHEMBL7457186 0.83 ESR1 (0.50) MAPTTDP1L3MBTL1ELANEAR
SCHEMBL7985696 0.82 KDM4E (0.36) MAPTTDP1L3MBTL1ELANEAR
SCHEMBL487660 0.80 MAPT (0.45) MAPTTDP1L3MBTL1ELANEAR
SCHEMBL14173071 0.80 ELANE (0.56) MAPTTDP1L3MBTL1ELANEAR
SCHEMBL30971 0.80 ELANE (0.56) MAPTTDP1L3MBTL1ELANEAR
SCHEMBL23422784 0.80 ESR1 (0.46) MAPTTDP1L3MBTL1ELANEAR
SCHEMBL9875126 0.79 ELANE (0.46) MAPTTDP1L3MBTL1ELANEHPGD
SCHEMBL10629411 0.79 LMNA (0.59) MAPTTDP1L3MBTL1ELANEAR
SCHEMBL5491320 0.79 LMNA (0.59) MAPTTDP1L3MBTL1ELANEAR

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
EP-1296634-B1 DENTAL MATERIAL CONTAINING PHOSPHONIC ACIDS MUEHLBAUER ERNST GMBH & CO KG (DE) 2005-09-21 EP disclosed
US-6902608-B2 Dental material containing phosphonic acids ERNST MUHLBAUER GMBH & CO., KG (DE) 2005-06-07 US disclosed
EP-0994172-B1 Single-component adhesive MUEHLBAUER ERNST GMBH & CO KG (DE) 2004-11-17 EP disclosed
US-20030167968-A1 Dental material containing phosphonic acids MÜHLBAUER TECHNOLOGY GMBH (DE) 2003-09-11 US disclosed
EP-1296634-A1 DENTAL MATERIAL CONTAINING PHOSPHONIC ACIDS Ernst Mühlbauer GmbH & Co.KG (DE) 2003-04-02 EP disclosed
WO-2002002057-A1 DENTAL MATERIAL CONTAINING PHOSPHONIC ACIDS ERNST MÜHLBAUER GMBH & CO. KG (DE) 2002-01-10 WO disclosed
EP-1169996-A1 Phosphonic acid containing dental material ERNST MÜHLBAUER KG (DE) 2002-01-09 EP disclosed
US-6255407-B1 MEDICAL ADHESIVE COMPRISING POLYMER HAVING ALKYL, ARYL AND/OR ALKENYL GROUPS AND SPACER GROUPS ATTACHED BY ESTER LINKAGES, OPEN-CHAIN AND/OR CYCLIC SILICONE AND/OR SILANE GROUPS ATTACHED TO SPACER, ETHYLENE GROUP ATTACHED TO SILICON GROUP ERNST MUHLBAUER KG (DE) 2001-07-03 US disclosed
EP-0994172-A2 Single-component adhesive ERNST MÜHLBAUER KG (DE) 2000-04-19 EP 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-20030167968-A1 Dental material containing phosphonic acids PHOSPHO1, EPN1, PTK2 MAPT 3016/4885TDP1 893/4885L3MBTL1 3224/4885

“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.