SCHEMBL3409577

SCHEMBL3409577

O=C(Nc1ccc(O[C@H]2CC[C@H](C(=O)O)CC2)cc1)c1nnc(Nc2ccc(F)c(F)c2)o1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 20/20 1.00
SOAT1 P35610 13/20 1.00
DGAT2 Q96PD7 1/20 0.62
ACAT1 P24752 1/20 0.55

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
SCHEMBL3409765 1.00 DGAT1 (1.00) DGAT1SOAT1DGAT2ACAT1
SCHEMBL3409581 1.00 DGAT1 (1.00) DGAT1SOAT1DGAT2ACAT1
SCHEMBL3408695 0.93 DGAT1 (0.86) DGAT1SOAT1DGAT2ACAT1
SCHEMBL3409281 0.93 DGAT1 (0.86) DGAT1SOAT1DGAT2ACAT1
SCHEMBL3540296 0.90 DGAT1 (1.00) DGAT1SOAT1DGAT2
SCHEMBL3540291 0.90 DGAT1 (1.00) DGAT1SOAT1DGAT2
SCHEMBL3541933 0.90 DGAT1 (1.00) DGAT1SOAT1DGAT2
Bicarbonate SCHEMBL3409767 0.90 DGAT1 (0.81) DGAT1SOAT1DGAT2ACAT1
SCHEMBL3411044 0.90 DGAT1 (1.00) DGAT1SOAT1DGAT2
SCHEMBL3410917 0.90 DGAT1 (1.00) DGAT1SOAT1DGAT2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8084478-B2 Substituted 5- phenylamino- 1, 3, 4-oxadiazol-2-ylcarbonylamino-4-phenoxy-cyclohexane carboxylic acid as inhibitors of acetyl coenzyme A diacylglycerol acyltransferase ASSTRAZENECA AB (SE) 2011-12-27 US claimed
EP-2041100-B1 SUBSTITUTED 5- PHENYLAMINO- 1, 3, 4-OXADIAZ0L-2-YLCARBONYLAMINO-4-PHENOXY-CYCLOHEXANE CARBOXYLIC ACID AS INHIBITORS OF ACETYL COENZYME A DIACYLGLYCEROL ACYLTRANSFERASE ASTRAZENECA AB (SE) 2010-12-22 EP claimed
US-20090275620-A1 SUBSTITUTED 5- PHENYLAMINO- 1, 3, 4-OXADIAZOL-2-YLCARBONYLAMINO-4-PHENOXY-CYCLOHEXANE CARBOXYLIC ACID AS INHIBITORS OF ACETYL COENZYME A DIACYLGLYCEROL ACYLTRANSFERASE ASTRAZENECA AB (SE) 2009-11-05 US claimed
EP-2041100-A1 SUBSTITUTED 5- PHENYLAMINO- 1, 3, 4-OXADIAZ0L-2-YLCARBONYLAMINO-4-PHENOXY-CYCLOHEXANE CARBOXYLIC ACID AS INHIBITORS OF ACETYL COENZYME A DIACYLGLYCEROL ACYLTRANSFERASE Astra Zeneca AB (SE) 2009-04-01 EP claimed
WO-2007138311-A1 SUBSTITUTED 5- PHENYLAMINO- 1, 3, 4-OXADIAZ0L-2-YLCARBONYLAMINO-4-PHENOXY-CYCLOHEXANE CARBOXYLIC ACID AS INHIBITORS OF ACETYL COENZYME A DIACYLGLYCEROL ACYLTRANSFERASE ASTRAZENECA AB (SE) 2007-12-06 WO claimed
US-8084478-B2 Substituted 5- phenylamino- 1, 3, 4-oxadiazol-2-ylcarbonylamino-4-phenoxy-cyclohexane carboxylic acid as inhibitors of acetyl coenzyme A diacylglycerol acyltransferase ASSTRAZENECA AB (SE) 2011-12-27 US disclosed
EP-2041100-B1 SUBSTITUTED 5- PHENYLAMINO- 1, 3, 4-OXADIAZ0L-2-YLCARBONYLAMINO-4-PHENOXY-CYCLOHEXANE CARBOXYLIC ACID AS INHIBITORS OF ACETYL COENZYME A DIACYLGLYCEROL ACYLTRANSFERASE ASTRAZENECA AB (SE) 2010-12-22 EP disclosed
US-20090275620-A1 SUBSTITUTED 5- PHENYLAMINO- 1, 3, 4-OXADIAZOL-2-YLCARBONYLAMINO-4-PHENOXY-CYCLOHEXANE CARBOXYLIC ACID AS INHIBITORS OF ACETYL COENZYME A DIACYLGLYCEROL ACYLTRANSFERASE ASTRAZENECA AB (SE) 2009-11-05 US disclosed
EP-2041100-A1 SUBSTITUTED 5- PHENYLAMINO- 1, 3, 4-OXADIAZ0L-2-YLCARBONYLAMINO-4-PHENOXY-CYCLOHEXANE CARBOXYLIC ACID AS INHIBITORS OF ACETYL COENZYME A DIACYLGLYCEROL ACYLTRANSFERASE Astra Zeneca AB (SE) 2009-04-01 EP disclosed
WO-2007138311-A1 SUBSTITUTED 5- PHENYLAMINO- 1, 3, 4-OXADIAZ0L-2-YLCARBONYLAMINO-4-PHENOXY-CYCLOHEXANE CARBOXYLIC ACID AS INHIBITORS OF ACETYL COENZYME A DIACYLGLYCEROL ACYLTRANSFERASE ASTRAZENECA AB (SE) 2007-12-06 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-20090275620-A1 SUBSTITUTED 5- PHENYLAMINO- 1, 3, 4-OXADIAZOL-2-YLCARBONYLAMINO-4-PHENOXY-CYCLOHEXANE CARBOXYLIC ACID AS INHIBITORS OF ACETYL COENZYME A DIACYLGLYCEROL ACYLTRANSFERASE ACAT2, ACAT1, DGAT1 DGAT1 3/4885SOAT1 11/4885DGAT2 4/4885

“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.