SCHEMBL22457640

SCHEMBL22457640

CNC(=O)[C@H](C)NC(=O)[C@H](C(C)C)N(C)C

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ FFAR2 O15552 1/20 0.33
▸ MMP1 P03956 1/20 0.32
▸ CHRNB2 P17787 2/20 0.31
▸ CHRNA4 P43681 2/20 0.31
▸ CHRNB4 P30926 1/20 0.31
▸ CHRNA3 P32297 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
SCHEMBL19522520 0.82 MMP1 (0.35) FFAR2MMP1CHRNB2CHRNA4CHRNB4
SCHEMBL22561303 0.82 MMP1 (0.35) FFAR2MMP1CHRNB2CHRNA4CHRNB4
SCHEMBL30408938 0.82 MMP1 (0.35) FFAR2MMP1CHRNB2CHRNA4CHRNB4
SCHEMBL25662649 0.82 MMP1 (0.35) FFAR2MMP1CHRNB2CHRNA4CHRNB4
SCHEMBL18048546 0.78 MMP2 (0.36) FFAR2MMP1CHRNB2CHRNA4CHRNB4
SCHEMBL18048547 0.78 MMP2 (0.36) FFAR2MMP1CHRNB2CHRNA4CHRNB4
SCHEMBL21335909 0.77 TAS1R3 (0.33) —
SCHEMBL22267487 0.77 MMP1 (0.39) MMP1
SCHEMBL25672807 0.75 ALDH1A1 (0.37) MMP1
SCHEMBL25139840 0.73 GAA (0.34) FFAR2MMP1

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-20200297859-A1 NON-LINEAR SELF-IMMOLATIVE LINKERS AND CONJUGATES THEREOF BYONDIS B.V. (NL) 2020-09-24 — — 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-20200297859-A1 NON-LINEAR SELF-IMMOLATIVE LINKERS AND CONJUGATES THEREOF DLST, ADSL, LANCL1 FFAR2 1886/4885MMP1 721/4885CHRNB2 3917/4885

“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.

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