SCHEMBL24540965

SCHEMBL24540965

C=CCC(C)[C@@H](N)CCC

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 1/20 0.33
MMP9 P14780 1/20 0.33
OPRM1 P35372 1/20 0.31
TSHR P16473 1/20 0.31
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL27252890 0.87 OPRM1 (0.38) OPRM1TSHRALDH1A1
SCHEMBL17202686 0.82 METAP1 (0.38) METAP1MMP9OPRM1TSHRALDH1A1
SCHEMBL24352948 0.82
SCHEMBL8367717 0.78 MMP9 (0.36) METAP1MMP9TSHRALDH1A1
SCHEMBL27234546 0.77 METAP1 (0.33) METAP1OPRM1
SCHEMBL5132479 0.76
SCHEMBL24547712 0.75 METAP1 (0.46) METAP1OPRM1TSHRALDH1A1
SCHEMBL19117382 0.75 METAP1 (0.46) METAP1OPRM1TSHRALDH1A1
SCHEMBL10257986 0.74 METAP1 (0.35) METAP1MMP9TSHR
SCHEMBL15540193 0.74 OPRM1 (0.38) OPRM1TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220193251-A1 CD30 TARGETING ANTIBODY DRUG CONJUGATES AND USES THEREOF LUDWIG-MAXIMILIANS-UNIVERSITAET MUENCHEN (DE) 2022-06-23 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-20220193251-A1 CD30 TARGETING ANTIBODY DRUG CONJUGATES AND USES THEREOF TUBB6, GALNT10, TUBB METAP1 1678/4885MMP9 4715/4885OPRM1 3989/4885

“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.