SCHEMBL9892967

SCHEMBL9892967

CO[C@H]([C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)[C@@H]1CCCN1C

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.49
ACE P12821 7/20 0.48
ALDH1A1 P00352 1/20 0.47
HSD17B10 Q99714 1/20 0.47
MME P08473 8/20 0.46
CPA1 P15085 5/20 0.46
ACE2 Q9BYF1 5/20 0.46
GAA P10253 1/20 0.45
LMNA P02545 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
KMT2A Q03164 1/20 0.44

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
SCHEMBL22810961 1.00 POLB (0.49) POLBACEALDH1A1HSD17B10MME
SCHEMBL21699252 1.00 POLB (0.49) POLBACEALDH1A1HSD17B10MME
SCHEMBL2734908 1.00 POLB (0.49) POLBACEALDH1A1HSD17B10MME
SCHEMBL15313443 1.00 POLB (0.49) POLBACEALDH1A1HSD17B10MME
SCHEMBL18912329 0.93 GAA (0.54) POLBALDH1A1HSD17B10GAALMNA
SCHEMBL19647312 0.93 GAA (0.54) POLBALDH1A1HSD17B10GAALMNA
SCHEMBL22600820 0.90 NPC1 (0.44) ACEMMEGAALMNAKMT2A
SCHEMBL26765974 0.90 NPC1 (0.44) ACEMMEGAALMNAKMT2A
SCHEMBL22476513 0.89 GAA (0.42) ACEALDH1A1HSD17B10GAA
SCHEMBL2755704 0.89 ALDH1A1 (0.52) POLBACEALDH1A1HSD17B10MME

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210393790-A1 CONJUGATION OF A CYTOTOXIC DRUG WITH BIS-LINKAGE HANGZHOU DAC BIOTECH CO., LTD. (CN) 2021-12-23 US disclosed
US-8557780-B2 Monomethylvaline compounds capable of conjugation to ligands SEATTLE GENETICS, INC. (US) 2013-10-15 US disclosed
US-8466260-B2 Anti-FcRH5 antibodies and immunoconjugates and methods of use GENENTECH, INC. (US) 2013-06-18 US disclosed
US-8466260-B2 Anti-FcRH5 antibodies and immunoconjugates and methods of use GENENTECH, INC. (US) 2013-06-18 US disclosed
US-20130136756-A1 ANTIBODY DRUG CONJUGATES (ADC) THAT BIND TO 24P4C12 PROTEINS SEATTLE GENETICS, INC. (US) 2013-05-30 US disclosed
US-8362213-B2 Anti-FcRH5 antibodies and immunoconjugates and methods of use GENENTECH, INC. (US) 2013-01-29 US disclosed
US-20120141509-A1 MONOMETHYLVALINE COMPOUNDS CAPABLE OF CONJUGATION TO LIGANDS SEATTLE GENETICS, INC. (US) 2012-06-07 US disclosed
US-20120027783-A1 MONOMETHYLVALINE COMPOUNDS CAPABLE OF CONJUGATION TO LIGANDS SEATTLE GENETICS, INC. (US) 2012-02-02 US disclosed
US-20110171125-A1 ANTI-FcRH5 ANTIBODIES AND IMMUNOCONJUGATES AND METHODS OF USE F. HOFFMANN-LA ROCHE AG (CH) 2011-07-14 US disclosed
US-7834154-B2 Anti-ROBO4 antibodies and uses therefor GENENTECH, INC. (US) 2010-11-16 US disclosed
US-20100260748-A1 ANTI-FcRH5 ANTIBODIES AND IMMUNOCONJUGATES AND METHODS OF USE F. HOFFMANN-LA ROCHE AG (CH) 2010-10-14 US disclosed
US-20100260748-A1 ANTI-FcRH5 ANTIBODIES AND IMMUNOCONJUGATES AND METHODS OF USE F. HOFFMANN-LA ROCHE AG (CH) 2010-10-14 US disclosed
US-7745394-B2 Antibody-drug conjugates; Auristatin peptides, including MeVal-Val-Dil-Dap-Norephedrine (MMAE) and MeVal-Val-Dil-Dap-Phe (MMAF); cancer; autoimmune diseases SEATTLE GENETICS, INC. (US) 2010-06-29 US disclosed
US-7745394-B2 Antibody-drug conjugates; Auristatin peptides, including MeVal-Val-Dil-Dap-Norephedrine (MMAE) and MeVal-Val-Dil-Dap-Phe (MMAF); cancer; autoimmune diseases SEATTLE GENETICS, INC. (US) 2010-06-29 US disclosed
US-7723485-B2 engineered by replacing one or more amino acids of a parent anti-MUC16 antibody with non cross-linked, reactive cysteine amino acids; Cys engineered anti-MUC16 antibodies (Ab) containing a heavy chain sequence, conjugated with one or more drug moieties through a linker; diagnostic and therapeutic uses GENENTECH, INC. (US) 2010-05-25 US disclosed
US-20080311134-A1 CYSTEINE ENGINEERED ANTI-MUC16 ANTIBODIES AND ANTIBODY DRUG CONJUGATES GENENTECH, INC. 2008-12-18 US disclosed
US-20080247951-A1 ANTI-ROBO4 ANTIBODIES AND USES THEREFOR GENENTECH, INC. (US) 2008-10-09 US disclosed
US-20080226657-A1 Antibody-drug conjugates; Auristatin peptides, including MeVal-Val-Dil-Dap-Norephedrine (MMAE) and MeVal-Val-Dil-Dap-Phe (MMAF); cancer; autoimmune diseases SEATTLE GENETICS, INC. (US) 2008-09-18 US disclosed
US-20080226657-A1 Antibody-drug conjugates; Auristatin peptides, including MeVal-Val-Dil-Dap-Norephedrine (MMAE) and MeVal-Val-Dil-Dap-Phe (MMAF); cancer; autoimmune diseases SEATTLE GENETICS, INC. (US) 2008-09-18 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 (9 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-20130136756-A1 ANTIBODY DRUG CONJUGATES (ADC) THAT BIND TO 24P4C12 PROTEINS CD2BP2, IGSF11, PA2G4 POLB 4076/4885ACE 4734/4885ALDH1A1 1372/4885
US-20120027783-A1 MONOMETHYLVALINE COMPOUNDS CAPABLE OF CONJUGATION TO LIGANDS MMAB, CAD, VIM POLB 3920/4885ACE 3491/4885ALDH1A1 3456/4885
US-20210393790-A1 CONJUGATION OF A CYTOTOXIC DRUG WITH BIS-LINKAGE CD4, MCL1, CCNB1 POLB 1625/4885ACE 4357/4885ALDH1A1 1130/4885
US-20110171125-A1 ANTI-FcRH5 ANTIBODIES AND IMMUNOCONJUGATES AND METHODS OF USE FCGR3B, FCGRT, FCGR1A POLB 3920/4885ACE 3277/4885ALDH1A1 3561/4885
US-20100260748-A1 ANTI-FcRH5 ANTIBODIES AND IMMUNOCONJUGATES AND METHODS OF USE FCGR3B, FCGRT, FCGR1A POLB 3920/4885ACE 3277/4885ALDH1A1 3561/4885
US-20120141509-A1 MONOMETHYLVALINE COMPOUNDS CAPABLE OF CONJUGATION TO LIGANDS MMAB, CAD, VIM POLB 3920/4885ACE 3491/4885ALDH1A1 3456/4885
US-20080226657-A1 Antibody-drug conjugates; Auristatin peptides, including MeVal-Val-Dil-Dap-Norephedrine (MMAE) and MeVal-Val-Dil-Dap-Phe (MMAF); cancer; autoimmune diseases MMAB, CAD, VIM POLB 4455/4885ACE 3395/4885ALDH1A1 3798/4885
US-20080311134-A1 CYSTEINE ENGINEERED ANTI-MUC16 ANTIBODIES AND ANTIBODY DRUG CONJUGATES MUC1, PDIA6, LNPEP POLB 4163/4885ACE 3599/4885ALDH1A1 721/4885
US-20080247951-A1 ANTI-ROBO4 ANTIBODIES AND USES THEREFOR IGSF11, MRPS18A, ANXA4 POLB 3002/4885ACE 3762/4885ALDH1A1 2472/4885

“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.