SCHEMBL13374875

SCHEMBL13374875

CC[C@H](C)[C@@H]([C@@H](CC(=O)OC(C)(C)C)OC)N(C)C(=O)[C@@H](N)C(C)C

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.33
DPP4 P27487 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
SCHEMBL21708027 1.00 CYP2D6 (0.33) CYP2D6DPP4
SCHEMBL17337592 1.00 CYP2D6 (0.33) CYP2D6DPP4
SCHEMBL21708028 1.00 CYP2D6 (0.33) CYP2D6DPP4
SCHEMBL17337593 1.00 CYP2D6 (0.33) CYP2D6DPP4
SCHEMBL18289855 1.00 CYP2D6 (0.33) CYP2D6DPP4
SCHEMBL25721685 1.00 CYP2D6 (0.33) CYP2D6DPP4
SCHEMBL14962705 1.00 CYP2D6 (0.33) CYP2D6DPP4
SCHEMBL18923780 0.91
SCHEMBL31032956 0.91 DPP4 (0.38) CYP2D6DPP4
SCHEMBL21117488 0.90 CYP2D6 (0.32) CYP2D6

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 153 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118598770-A Salt for synthesizing intermediate of monomethyl auristatin E, and preparation method and application thereof 无锡药明合联生物技术有限公司 2024-09-06 CN claimed
CN-113416229-B Cytotoxic and antimitotic compounds and methods of use thereof 酵活英属哥伦比亚有限公司 2024-12-13 CN disclosed
US-12152083-B2 Cytotoxic and anti-mitotic compounds, and methods of using the same ZYMEWORKS BC INC. 2024-11-26 US disclosed
CN-118598770-A Salt for synthesizing intermediate of monomethyl auristatin E, and preparation method and application thereof 无锡药明合联生物技术有限公司 2024-09-06 CN disclosed
CN-118598770-A Salt for synthesizing intermediate of monomethyl auristatin E, and preparation method and application thereof 无锡药明合联生物技术有限公司 2024-09-06 CN disclosed
US-11918656-B2 Antibody-drug-conjugate and its use for the treatment of cancer PIERRE FABRE MEDICAMENT (FR) 2024-03-05 US disclosed
US-20230317700-A1 CYTOTOXIC AND ANTI-MITOTIC COMPOUNDS, AND METHODS OF USING THE SAME ZYMEWORKS BC INC. (CA) 2023-10-05 US disclosed
US-20230317700-A1 CYTOTOXIC AND ANTI-MITOTIC COMPOUNDS, AND METHODS OF USING THE SAME ZYMEWORKS BC INC. (CA) 2023-10-05 US disclosed
US-11661457-B2 IGF-1R antibody-drug-conjugate and its use for the treatment of cancer PIERRE FABRE MEDICAMENT (FR) 2023-05-30 US disclosed
US-20230071763-A1 AURISTATIN-RELATED COMPOUNDS, CONJUGATED AURISTATIN-RELATED COMPOUNDS, AND METHODS OF USE THEREOF CYTOMX THERAPEUTICS INC (US) 2023-03-09 US disclosed
WO-2012143496-A2 NOVEL BINDER-DRUG CONJUGATES (ADCS) AND THEIR USE BAYER INTELLECTUAL PROPERTY GMBH (DE) 2012-10-26 WO disclosed
WO-2012143496-A2 NOVEL BINDER-DRUG CONJUGATES (ADCS) AND THEIR USE BAYER INTELLECTUAL PROPERTY GMBH (DE) 2012-10-26 WO disclosed
WO-2012143495-A2 NOVEL BINDER-DRUG CONJUGATES (ADCS) AND THEIR USE BAYER INTELLECTUAL PROPERTY GMBH (DE) 2012-10-26 WO disclosed
WO-2012143495-A2 NOVEL BINDER-DRUG CONJUGATES (ADCS) AND THEIR USE BAYER INTELLECTUAL PROPERTY GMBH (DE) 2012-10-26 WO disclosed
US-8288352-B2 Auristatins having an aminobenzoic acid unit at the N terminus SEATTLE GENETICS, INC. (US) 2012-10-16 US disclosed
US-8288352-B2 Auristatins having an aminobenzoic acid unit at the N terminus SEATTLE GENETICS, INC. (US) 2012-10-16 US disclosed
WO-2011154359-A1 NOVEL AURISTATIN DERIVATIVES AND USE THEREOF BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2011-12-15 WO disclosed
WO-2011154359-A1 NOVEL AURISTATIN DERIVATIVES AND USE THEREOF BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2011-12-15 WO disclosed
US-20080300192-A1 Auristatins Having an Aminobenzoic Acid Unit at the N Terminus SEATTLE GENETICS, INC. (US) 2008-12-04 US disclosed
US-20080300192-A1 Auristatins Having an Aminobenzoic Acid Unit at the N Terminus SEATTLE GENETICS, INC. (US) 2008-12-04 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 (5 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-20230071763-A1 AURISTATIN-RELATED COMPOUNDS, CONJUGATED AURISTATIN-RELATED COMPOUNDS, AND METHODS OF USE THEREOF AURKC, AURKA, AURKB CYP2D6 4787/4885DPP4 3207/4885
US-11918656-B2 Antibody-drug-conjugate and its use for the treatment of cancer DDOST, DAD1, KRTCAP2 CYP2D6 990/4885DPP4 1204/4885
US-12152083-B2 Cytotoxic and anti-mitotic compounds, and methods of using the same CCNB1, PLK1, BOD1L1 CYP2D6 3275/4885DPP4 2986/4885
US-11661457-B2 IGF-1R antibody-drug-conjugate and its use for the treatment of cancer IGF1R, IGFBP1, IGFBP5 CYP2D6 3056/4885DPP4 1664/4885
US-20080300192-A1 Auristatins Having an Aminobenzoic Acid Unit at the N Terminus AURKB, AURKA, AURKC CYP2D6 4336/4885DPP4 1779/4885

“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.