SCHEMBL25499345

SCHEMBL25499345

COC(=O)CC(N)C(=O)N1CCN(CCCCC(C)C)CC1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HRH2 P25021 14/20 0.42
HRH1 P35367 14/20 0.42
TP53 P04637 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
FPR3 P25089 2/20 0.38
FPR2 P25090 2/20 0.38
OPRK1 P41145 3/20 0.38
HRH3 Q9Y5N1 1/20 0.37

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
SCHEMBL25499344 0.96 HRH2 (0.43) HRH2HRH1TP53SMN1; SMN2FPR3
SCHEMBL25502988 0.87 HRH2 (0.48) HRH2HRH1OPRK1
SCHEMBL25504368 0.86 HRH2 (0.47) HRH2HRH1OPRK1
SCHEMBL25500680 0.85 HRH2 (0.47) HRH2HRH1OPRK1
SCHEMBL26040706 0.84 HRH2 (0.44) HRH2HRH1FPR3FPR2OPRK1
SCHEMBL25499378 0.80 HRH2 (0.47) HRH2HRH1OPRK1
SCHEMBL25499365 0.80 HRH2 (0.41) HRH2HRH1TP53SMN1; SMN2FPR3
SCHEMBL25499358 0.80 OPRK1 (0.38) OPRK1
SCHEMBL25499341 0.79 OPRK1 (0.39) OPRK1
SCHEMBL25499367 0.77 HRH2 (0.41) HRH2HRH1TP53SMN1; SMN2OPRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11739076-B2 Compound or its salt thereof targeting fibroblast activation protein, its preparation methods and its uses thereof INSTITUTE OF NUCLEAR ENERGY RESEARCH ATOMIC ENERGY COUNCIL, R.O.C. (TW) 2023-08-29 US disclosed
US-11739076-B2 Compound or its salt thereof targeting fibroblast activation protein, its preparation methods and its uses thereof INSTITUTE OF NUCLEAR ENERGY RESEARCH ATOMIC ENERGY COUNCIL, R.O.C. (TW) 2023-08-29 US disclosed
US-20230159495-A1 COMPOUND OR ITS SALT THEREOF TARGETING FIBROBLAST ACTIVATION PROTEIN, ITS PREPARATION METHODS AND ITS USES THEREOF INSTITUTE OF NUCLEAR ENERGY RESEARCH ATOMIC ENERGY COUNCIL, R.O.C. (TW) 2023-05-25 US disclosed
US-20230159495-A1 COMPOUND OR ITS SALT THEREOF TARGETING FIBROBLAST ACTIVATION PROTEIN, ITS PREPARATION METHODS AND ITS USES THEREOF INSTITUTE OF NUCLEAR ENERGY RESEARCH ATOMIC ENERGY COUNCIL, R.O.C. (TW) 2023-05-25 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-11739076-B2 Compound or its salt thereof targeting fibroblast activation protein, its preparation methods and its uses thereof FIBP, FGFR2, FGFR1 HRH2 3821/4885HRH1 2968/4885TP53 1625/4885
US-20230159495-A1 COMPOUND OR ITS SALT THEREOF TARGETING FIBROBLAST ACTIVATION PROTEIN, ITS PREPARATION METHODS AND ITS USES THEREOF FIBP, FGFR2, FGFR1 HRH2 3821/4885HRH1 2968/4885TP53 1625/4885

“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.