SCHEMBL18928362

SCHEMBL18928362

COC(=O)c1csc([C@H](O)CC(NC(=O)OC(C)(C)C)C(C)C)n1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 6/20 0.54
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
CA7 P43166 2/20 0.43
CA4 P22748 1/20 0.38
CA9 Q16790 1/20 0.38
PTPRB P23467 8/20 0.36
KLK5 Q9Y337 1/20 0.36
CYP2D6 P10635 1/20 0.35

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
SCHEMBL15432495 1.00 ABCB1 (0.54) ABCB1CA1CA2CA7CA4
SCHEMBL13108147 1.00 ABCB1 (0.54) ABCB1CA1CA2CA7CA4
SCHEMBL24140388 0.91 ABCB1 (0.67) ABCB1CA1CA2CA7PTPRB
SCHEMBL24140416 0.91 ABCB1 (0.67) ABCB1CA1CA2CA7PTPRB
SCHEMBL28923528 0.91 ABCB1 (0.67) ABCB1CA1CA2CA7PTPRB
SCHEMBL15947604 0.90 ABCB1 (0.50) ABCB1CA1CA2CA7CA4
SCHEMBL20800061 0.90 ABCB1 (0.50) ABCB1CA1CA2CA7CA4
SCHEMBL15947618 0.87 ABCB1 (0.41) ABCB1CA1CA2CA9PTPRB
SCHEMBL15433017 0.85 ABCB1 (0.53) ABCB1CA1CA2CA7CA4
SCHEMBL18928619 0.85 ABCB1 (0.53) ABCB1CA1CA2CA7CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2872157-B1 CONJUGATES OF CELL BINDING MOLECULES WITH CYTOTOXIC AGENTS HANGZHOU DAC BIOTECH CO LTD (CN) 2020-01-22 EP disclosed
US-10399941-B2 Conjugates of cell binding molecules with cytotoxic agents HANGZHOU DAC BIOTECH CO., LTD. (CN) 2019-09-03 US disclosed
US-20180021448-A9 Conjugates of Cell Binding Molecules with Cytotoxic Agents HANGZHOU DAC BIOTECH CO., LTD. (CN) 2018-01-25 US disclosed
US-20170296663-A1 Conjugates of Cell Binding Molecules with Cytotoxic Agents HANGZHOU DAC BIOTECH CO., LTD. (CN) 2017-10-19 US disclosed
US-20170157262-A1 CONJUGATES OF CELL BINDING MOLECULES WITH CYTOTOXIC AGENTS HANGZHOU DAC BIOTECH CO., LTD (CN) 2017-06-08 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 (4 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-10399941-B2 Conjugates of cell binding molecules with cytotoxic agents CD4, CD2, CD47 ABCB1 944/4885CA1 2258/4885CA2 4016/4885
US-20170157262-A1 CONJUGATES OF CELL BINDING MOLECULES WITH CYTOTOXIC AGENTS CD4, CD2, CD47 ABCB1 973/4885CA1 2346/4885CA2 3901/4885
US-20180021448-A9 Conjugates of Cell Binding Molecules with Cytotoxic Agents CD4, CD2, CD47 ABCB1 944/4885CA1 2258/4885CA2 4016/4885
US-20170296663-A1 Conjugates of Cell Binding Molecules with Cytotoxic Agents CD4, CD2, CD47 ABCB1 944/4885CA1 2258/4885CA2 4016/4885

“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.