SCHEMBL773741

SCHEMBL773741

O=C(NCCO)C1(CCCCCCCCCCCCC2(C(=O)NCCO)CC2)CC1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 2/20 0.47
CYP4A11 Q02928 2/20 0.47
SMN1; SMN2 Q16637 3/20 0.40
HTT P42858 1/20 0.40
HPGD P15428 2/20 0.36
LMNA P02545 1/20 0.36
NPSR1 Q6W5P4 1/20 0.35
MEN1 O00255 1/20 0.34
USP2 O75604 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.34
KMT2A Q03164 1/20 0.34
EPHX2 P34913 5/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C19 P33261 1/20 0.33
SPHK1 Q9NYA1 5/20 0.33
CETP P11597 2/20 0.32

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
SCHEMBL772929 0.93 CYP4F2 (0.42) CYP4F2CYP4A11SMN1; SMN2HTTHPGD
SCHEMBL882503 0.90 CYP4F2 (0.41) CYP4F2CYP4A11SMN1; SMN2HTTHPGD
SCHEMBL15692289 0.86 CYP4F2 (0.41) CYP4F2CYP4A11SMN1; SMN2HTTHPGD
SCHEMBL798386 0.84 CYP4F2 (0.50) CYP4F2CYP4A11LMNAMEN1ALDH1A1
SCHEMBL5449643 0.83 SPHK1 (0.50) CYP4F2CYP4A11SPHK1
SCHEMBL5450521 0.83 SPHK1 (0.50) CYP4F2CYP4A11SPHK1
SCHEMBL3682206 0.79 SPHK1 (0.54) SMN1; SMN2HPGDLMNASPHK1CETP
SCHEMBL22761937 0.77 CYP4F2 (0.38) CYP4F2CYP4A11SMN1; SMN2HPGDLMNA
SCHEMBL28594860 0.73 FAAH (0.46) CYP4F2CYP4A11SPHK1CETP
SCHEMBL8333228 0.72 SPHK1 (0.54) SMN1; SMN2HPGDLMNANPSR1SPHK1

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
US-20230364039-A1 Methods of Managing Side Effects of a Vasopressin Receptor Antagonist Therapy UNIV EMORY (US) 2023-11-16 US disclosed
US-20140142178-A1 METHODS AND COMPOSITIONS FOR TREATMENT OF DIABETES AND DYSLIPIDEMIA KAREUS THERAPEUTICS, SA (CH) 2014-05-22 US disclosed
US-20140142178-A1 METHODS AND COMPOSITIONS FOR TREATMENT OF DIABETES AND DYSLIPIDEMIA KAREUS THERAPEUTICS, SA (CH) 2014-05-22 US disclosed
US-20140121267-A1 METHODS AND COMPOSITIONS FOR TREATMENT OF DIABETES AND DYSLIPIDEMIA KAREUS THERAPEUTICS, SA (CH) 2014-05-01 US disclosed
US-20140121267-A1 METHODS AND COMPOSITIONS FOR TREATMENT OF DIABETES AND DYSLIPIDEMIA KAREUS THERAPEUTICS, SA (CH) 2014-05-01 US disclosed
US-8623897-B2 Methods and compositions for treatment of diabetes and dyslipidemia KAREUS THERAPEUTICS, SA (CH) 2014-01-07 US disclosed
US-8623897-B2 Methods and compositions for treatment of diabetes and dyslipidemia KAREUS THERAPEUTICS, SA (CH) 2014-01-07 US disclosed
US-20120071528-A1 METHODS AND COMPOSITIONS FOR TREATMENT OF DIABETES AND DYSLIPIDEMIA KAREUS THERAPEUTICS, SA (CH) 2012-03-22 US disclosed
US-20120071528-A1 METHODS AND COMPOSITIONS FOR TREATMENT OF DIABETES AND DYSLIPIDEMIA KAREUS THERAPEUTICS, SA (CH) 2012-03-22 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 (4 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-20120071528-A1 METHODS AND COMPOSITIONS FOR TREATMENT OF DIABETES AND DYSLIPIDEMIA LIPC, PNLIP, LIPA CYP4F2 361/4885CYP4A11 66/4885SMN1; SMN2 4614/4885
US-20230364039-A1 Methods of Managing Side Effects of a Vasopressin Receptor Antagonist Therapy AVPR2, AVPR1A, AVPR1B CYP4F2 4874/4885CYP4A11 4735/4885SMN1; SMN2 2961/4885
US-20140121267-A1 METHODS AND COMPOSITIONS FOR TREATMENT OF DIABETES AND DYSLIPIDEMIA GPR119, FFAR1, INSR CYP4F2 1151/4885CYP4A11 145/4885SMN1; SMN2 2359/4885
US-20140142178-A1 METHODS AND COMPOSITIONS FOR TREATMENT OF DIABETES AND DYSLIPIDEMIA DHCR7, INSR, GPR119 CYP4F2 1069/4885CYP4A11 289/4885SMN1; SMN2 3834/4885

“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.