SCHEMBL4248802

SCHEMBL4248802

CC(C)(C)OC(=O)C(Br)C(Br)C(=O)OC(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.37
KMT2A Q03164 2/20 0.36
LMNA P02545 1/20 0.36
CA12 O43570 3/20 0.33
AAK1 Q2M2I8 1/20 0.33
CA14 Q9ULX7 1/20 0.33
CA1 P00915 3/20 0.32
CA2 P00918 3/20 0.32
CA7 P43166 1/20 0.32
CYP2C19 P33261 1/20 0.32
NOS1 P29475 2/20 0.32
NOS3 P29474 1/20 0.32
NOS2 P35228 1/20 0.32
MEN1 O00255 1/20 0.31
GAA P10253 1/20 0.31
CA9 Q16790 2/20 0.31
APLNR P35414 1/20 0.31
USP2 O75604 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL3210435 0.87 CA1 (0.37) DGAT1KMT2ALMNACA12CA14
SCHEMBL9784197 0.83 DGAT1 (0.37) DGAT1KMT2ALMNACA12AAK1
SCHEMBL8773691 0.83 DGAT1 (0.37) DGAT1KMT2ALMNACA12AAK1
SCHEMBL6207363 0.81 CA12 (0.36) DGAT1KMT2ALMNACA12CA14
SCHEMBL6207655 0.81 CA12 (0.36) DGAT1KMT2ALMNACA12CA14
SCHEMBL162214 0.81 CA12 (0.36) DGAT1KMT2ALMNACA12CA14
SCHEMBL14830923 0.79 APLNR (0.36) DGAT1KMT2ALMNACA12AAK1
SCHEMBL31099064 0.79 CA12 (0.35) DGAT1KMT2ALMNACA12CA14
SCHEMBL901385 0.79 CA12 (0.35) DGAT1KMT2ALMNACA12CA14
SCHEMBL2962998 0.78 CA14 (0.41) DGAT1KMT2ALMNACA12CA14

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
EP-2105431-A1 Process for Producing Chromone Compound Sumitomo Chemical Company, Limited (JP) 2009-09-30 EP disclosed
EP-2105432-A1 Process for Producing Chromone Compound Sumitomo Chemical Company, Limited (JP) 2009-09-30 EP disclosed
EP-1867626-A2 Process for producing chromone compound Sumitomo Chemical Company, Limited (JP) 2007-12-19 EP disclosed
US-20060217565-A1 Process for producing chromone compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2006-09-28 US disclosed
US-7094914-B2 Process for producing chromone compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2006-08-22 US disclosed
US-20050085664-A1 Process for producing chromone compound SUMITOMO CHEMICAL COMPANY, LMITED (JP) 2005-04-21 US disclosed
EP-1479667-A1 PROCESS FOR PRODUCING CHROMONE COMPOUND Sumitomo Chemical Company, Limited (JP) 2004-11-24 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 (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-20050085664-A1 Process for producing chromone compound ENY2, CDY1; CDY1B, CDYL DGAT1 2609/4885KMT2A 1072/4885LMNA 1091/4885
US-20060217565-A1 Process for producing chromone compound ENY2, CDY1; CDY1B, CDYL DGAT1 2609/4885KMT2A 1072/4885LMNA 1091/4885

“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.