SCHEMBL5536191

SCHEMBL5536191

COC(=O)Cc1ccc(-c2ccc(OS(=O)(=O)C(F)(F)F)c(C)c2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 4/20 0.43
RXRB P28702 4/20 0.43
RXRG P48443 4/20 0.43
CYP4F2 P78329 1/20 0.43
CYP4A11 Q02928 1/20 0.43
ACLY P53396 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
RECQL P46063 1/20 0.40
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
PPARG P37231 1/20 0.39
PPARA Q07869 1/20 0.39
NR1H4 Q96RI1 1/20 0.38
SYK P43405 1/20 0.38
MRGPRX4 Q96LA9 1/20 0.37
PDK2 Q15119 1/20 0.37
ALDH1A1 P00352 1/20 0.36
GAA P10253 1/20 0.36
GFER P55789 1/20 0.36

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
SCHEMBL2127345 0.90 CYP4F2 (0.43) CYP4F2CYP4A11L3MBTL1NPC1RAB9A
SCHEMBL5538842 0.88 CA5A (0.47) RXRARXRBRXRGCYP4F2CYP4A11
SCHEMBL1525474 0.83 VDR (0.39) RXRARXRBRXRGCYP4F2CYP4A11
SCHEMBL5537348 0.82 CYP4F2 (0.43) RXRARXRBRXRGCYP4F2CYP4A11
SCHEMBL1525500 0.82 RXRA (0.39) RXRARXRBRXRGCYP4F2CYP4A11
SCHEMBL14418901 0.81 L3MBTL1 (0.51) CYP4F2CYP4A11ACLYL3MBTL1RECQL
SCHEMBL2126108 0.80 CYP4F2 (0.43) CYP4F2CYP4A11NPC1RAB9ASMN1; SMN2
SCHEMBL5738807 0.80 CA5A (0.51) CYP4F2CYP4A11NPC1PDK2ALDH1A1
SCHEMBL30154424 0.80 CYP4F2 (0.43) CYP4F2CYP4A11NPC1RAB9ASMN1; SMN2
SCHEMBL4842048 0.80 CA5A (0.58) CYP4F2CYP4A11NPC1PDK2ALDH1A1

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-20120108602-A1 Carbamoyl Compounds as DGAT1 Inhibitors 190 ASTRAZENECA AB (SE) 2012-05-03 US disclosed
US-20120108602-A1 Carbamoyl Compounds as DGAT1 Inhibitors 190 ASTRAZENECA AB (SE) 2012-05-03 US disclosed
US-7994179-B2 Carbamoyl compounds as DGAT1 inhibitors 190 ASTRAZENECA AB (SE) 2011-08-09 US disclosed
US-7994179-B2 Carbamoyl compounds as DGAT1 inhibitors 190 ASTRAZENECA AB (SE) 2011-08-09 US disclosed
US-20090298853-A1 Carbamoyl Compounds as DGAT1 Inhibitors 190 ASTRAZENECA AB (SE) 2009-12-03 US disclosed
US-20090298853-A1 Carbamoyl Compounds as DGAT1 Inhibitors 190 ASTRAZENECA AB (SE) 2009-12-03 US 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-20120108602-A1 Carbamoyl Compounds as DGAT1 Inhibitors 190 DGAT1, DGAT2, SOAT1 RXRA 559/4885RXRB 519/4885RXRG 903/4885
US-20090298853-A1 Carbamoyl Compounds as DGAT1 Inhibitors 190 DGAT1, DGAT2, SOAT1 RXRA 549/4885RXRB 506/4885RXRG 869/4885

“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.