SCHEMBL15340973

SCHEMBL15340973

CC(C)(C)OC(=O)CNC(N)=S

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
CA12 O43570 3/20 0.40
CA2 P00918 3/20 0.40
CA14 Q9ULX7 1/20 0.40
PTPRC P08575 2/20 0.37
ALDH1A1 P00352 1/20 0.36
CA1 P00915 2/20 0.36
CA9 Q16790 2/20 0.36
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
DGAT1 O75907 1/20 0.34
CYP2D6 P10635 1/20 0.34
GAA P10253 2/20 0.33
TET2 Q6N021 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
TAS2R38 P59533 1/20 0.33

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
SCHEMBL3314336 0.83 MAOA (0.43) MAOAMAOBCA12CA2CA14
SCHEMBL3453208 0.82 MLYCD (0.39) MAOAMAOBCA12CA2CA14
SCHEMBL27687085 0.80
SCHEMBL1926396 0.80 MAOA (0.39) MAOAMAOBCA12CA2CA14
SCHEMBL27275384 0.79 MAOA (0.41) MAOAMAOBCA12CA2CA14
SCHEMBL2086711 0.78 DGAT1 (0.37) MAOAMAOBCA12CA2CA14
SCHEMBL6610608 0.78 MEN1 (0.41) MAOAMAOBCA12CA2CA14
SCHEMBL7907523 0.78 ALDH1A1 (0.37) MAOAMAOBCA12CA2CA14
SCHEMBL14729453 0.77 EPHX2 (0.52) MAOAMAOBCA12CA2CA1
SCHEMBL2842540 0.77 MEN1 (0.43) MAOAMAOBCA12CA2CA14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9169295-B2 Macrocycles and macrocycle stabilized peptides BRISTOL-MYERS SQUIBB COMPANY (US) 2015-10-27 US disclosed
US-9169295-B2 Macrocycles and macrocycle stabilized peptides BRISTOL-MYERS SQUIBB COMPANY (US) 2015-10-27 US disclosed
EP-2627662-B1 METHODS FOR PREPARING MACROCYCLES AND MACROCYCLE STABILIZED PEPTIDES BRISTOL MYERS SQUIBB CO (US) 2015-09-16 EP disclosed
US-20130281657-A1 MACROCYCLES AND MACROCYCLE STABILIZED PEPTIDES BRISTOL-MYERS SQUIBB COMPANY (US) 2013-10-24 US disclosed
US-20130281657-A1 MACROCYCLES AND MACROCYCLE STABILIZED PEPTIDES BRISTOL-MYERS SQUIBB COMPANY (US) 2013-10-24 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 (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-20130281657-A1 MACROCYCLES AND MACROCYCLE STABILIZED PEPTIDES PTMS, VIP, MTPN MAOA 4618/4885MAOB 4604/4885CA12 3209/4885

“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.