SCHEMBL20846207

SCHEMBL20846207

CCC(C)C(=O)C1CCN(C(=O)Oc2ccc(C[C@@H](CN)NC(=O)[C@H](C)[C@@H](OC)[C@@H]3CCCN3C(=O)C[C@@H](OC)[C@H]([C@@H](C)CC)N(C)C(=O)[C@@H](NC(=O)C(C(C)C)N(C)C)C(C)C)cc2)CC1

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SSTR2 P30874 2/20 0.36
FOLH1 Q04609 3/20 0.34
CYP3A4 P08684 1/20 0.34
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
TTR P02766 2/20 0.30

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
SCHEMBL24307583 0.88 SSTR2 (0.39) SSTR2FOLH1CYP3A4TTR
SCHEMBL24080487 0.88 SSTR2 (0.39) SSTR2FOLH1CYP3A4TTR
SCHEMBL20846248 0.87 SSTR2 (0.35) SSTR2FOLH1CYP3A4
SCHEMBL24080477 0.87 SSTR2 (0.38) SSTR2FOLH1CYP3A4TTR
SCHEMBL20846019 0.86 SSTR2 (0.36) SSTR2FOLH1CYP3A4TTR
SCHEMBL24080480 0.85 SSTR2 (0.38) SSTR2FOLH1CYP3A4TTR
SCHEMBL20846112 0.85 SSTR2 (0.35) SSTR2FOLH1CYP3A4
SCHEMBL19084367 0.85 CYP3A4 (0.37) SSTR2FOLH1CYP3A4TTR
SCHEMBL20846103 0.84 CYP3A4 (0.40) SSTR2FOLH1CYP3A4TTR
SCHEMBL24465496 0.84 SSTR2 (0.37) SSTR2FOLH1CYP3A4TTR

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-20190091345-A1 ANTI-HER2 ANTIBODY-DRUG CONJUGATE AND APPLICATION THEREOF HANGZHOU ADCORIS BIOPHARMA CO., LTD. (CN) 2019-03-28 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-20190091345-A1 ANTI-HER2 ANTIBODY-DRUG CONJUGATE AND APPLICATION THEREOF ERBB2, EGFR, ERBB3 SSTR2 141/4885FOLH1 111/4885CYP3A4 3734/4885

“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.