SCHEMBL16668245

SCHEMBL16668245

COC(=O)C(CC(C)C)NC(=O)C(N)CO

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MME P08473 2/20 0.53
BIRC2 Q13490 4/20 0.51
FOLH1 Q04609 1/20 0.47
TAS1R3 Q7RTX0 4/20 0.47
TAS1R1 Q7RTX1 4/20 0.47
SMN1; SMN2 Q16637 1/20 0.46
POLB P06746 1/20 0.44
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA9 Q16790 1/20 0.43

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
SCHEMBL11214006 0.90 BIRC2 (0.54) MMEBIRC2FOLH1TAS1R3TAS1R1
SCHEMBL11212280 0.90 BIRC2 (0.54) MMEBIRC2FOLH1TAS1R3TAS1R1
SCHEMBL56187 0.90 BIRC2 (0.54) MMEBIRC2FOLH1TAS1R3TAS1R1
SCHEMBL6425231 0.90 BIRC2 (0.54) MMEBIRC2FOLH1TAS1R3TAS1R1
SCHEMBL1432909 0.90 BIRC2 (0.54) MMEBIRC2FOLH1TAS1R3TAS1R1
SCHEMBL24049286 0.90 BIRC2 (0.54) MMEBIRC2FOLH1TAS1R3TAS1R1
Hydrochloric Acid SCHEMBL17801789 0.88 BIRC2 (0.52) MMEBIRC2FOLH1TAS1R3TAS1R1
Hydrochloric Acid SCHEMBL11592748 0.88 BIRC2 (0.52) MMEBIRC2FOLH1TAS1R3TAS1R1
Hydrochloric Acid SCHEMBL17801790 0.88 BIRC2 (0.52) MMEBIRC2FOLH1TAS1R3TAS1R1
Bromide SCHEMBL5062038 0.88 BIRC2 (0.52) MMEBIRC2FOLH1TAS1R3TAS1R1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150119251-A1 AGRICULTURAL PLANT-PROTECTING AGENTS CONTAINING DIPEPTIDE DERIVATIVE AS ACTIVE INGREDIENT REPUBLIC OF KOREA (RURAL DEVELOPMENT ADMINISTRATION) (KR) 2015-04-30 US claimed
US-20150119251-A1 AGRICULTURAL PLANT-PROTECTING AGENTS CONTAINING DIPEPTIDE DERIVATIVE AS ACTIVE INGREDIENT REPUBLIC OF KOREA (RURAL DEVELOPMENT ADMINISTRATION) (KR) 2015-04-30 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-20150119251-A1 AGRICULTURAL PLANT-PROTECTING AGENTS CONTAINING DIPEPTIDE DERIVATIVE AS ACTIVE INGREDIENT PEPD, DNPEP, DPP7 MME 495/4885BIRC2 509/4885FOLH1 1360/4885

“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.