SCHEMBL2145232

SCHEMBL2145232

CCOC(=O)c1oc(/C=C/c2ccccc2)nc1C(F)(F)F

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 3/20 0.45
TARBP2 Q15633 1/20 0.44
KDM4E B2RXH2 9/20 0.41
ALDH1A1 P00352 7/20 0.41
HPGD P15428 7/20 0.41
CYP1A2 P05177 2/20 0.41
CYP2C9 P11712 2/20 0.41
CYP2C19 P33261 2/20 0.41
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
MAPT P10636 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
XBP1 P17861 1/20 0.41
CTDSP1 Q9GZU7 1/20 0.41
NPSR1 Q6W5P4 3/20 0.40
LMNA P02545 1/20 0.40
RAB9A P51151 1/20 0.40
UTRN P46939 1/20 0.40
GLA P06280 2/20 0.39
CYP3A4 P08684 1/20 0.39

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
SCHEMBL2145238 1.00 ADORA3 (0.45) ADORA3TARBP2KDM4EALDH1A1HPGD
SCHEMBL2145509 0.82 ELANE (0.44) KDM4EALDH1A1HPGDKMT2AMEN1
SCHEMBL2145510 0.82 ELANE (0.44) KDM4EALDH1A1HPGDKMT2AMEN1
SCHEMBL10812842 0.80 TARBP2 (0.59) ADORA3TARBP2KDM4EALDH1A1HPGD
SCHEMBL10812846 0.80 TARBP2 (0.59) ADORA3TARBP2KDM4EALDH1A1HPGD
SCHEMBL2790527 0.78 TARBP2 (0.56) TARBP2KDM4EALDH1A1HPGDCYP1A2
SCHEMBL11171845 0.76 CYP1A2 (0.45) TARBP2KDM4EALDH1A1HPGDCYP1A2
SCHEMBL9750741 0.75 MAPT (0.49) KDM4EALDH1A1HPGDCYP1A2CYP2C9
SCHEMBL9750592 0.74 KDM4E (0.42) TARBP2KDM4EALDH1A1HPGDCYP1A2
SCHEMBL10815887 0.74 MAPT (0.49) TARBP2KMT2AMEN1MAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110224136-A1 INHIBITORS OF DIACYLGLYCEROL ACYLTRANSFERASE MERCK SHARP & DOHME CORP 2011-09-15 US disclosed
US-20110224136-A1 INHIBITORS OF DIACYLGLYCEROL ACYLTRANSFERASE MERCK SHARP & DOHME CORP 2011-09-15 US disclosed
US-20110224136-A1 INHIBITORS OF DIACYLGLYCEROL ACYLTRANSFERASE MERCK SHARP & DOHME CORP 2011-09-15 US disclosed
EP-2346853-A2 INHIBITORS OF DIACYLGLYCEROL ACYLTRANSFERASE Schering Corporation (US) 2011-07-27 EP disclosed
WO-2010059606-A2 INHIBITORS OF DIACYLGLYCEROL ACYLTRANSFERASE SCHERING CORPORATION (US) 2010-05-27 WO disclosed
WO-2010059606-A2 INHIBITORS OF DIACYLGLYCEROL ACYLTRANSFERASE SCHERING CORPORATION (US) 2010-05-27 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 (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-20110224136-A1 INHIBITORS OF DIACYLGLYCEROL ACYLTRANSFERASE DGAT2, DGAT1, LCAT ADORA3 2360/4885TARBP2 4192/4885KDM4E 1365/4885

“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.