SCHEMBL9943152

SCHEMBL9943152

CCc1ccc(NC(=O)[C@H](CCCNC(N)=O)NC(=O)[C@@H](NC(=O)CCCCCN2C(=O)C=CC2=O)C(C)C)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FAP Q12884 5/20 0.47
▸ FURIN P09958 2/20 0.43
▸ NPY5R Q15761 5/20 0.38
▸ NPY4R P50391 5/20 0.38
▸ NPY1R P25929 4/20 0.38
▸ NPY2R P49146 2/20 0.38
▸ HTT P42858 1/20 0.38
▸ ROCK2 O75116 1/20 0.36
▸ CTSL P07711 1/20 0.35
▸ MAP1LC3B Q9GZQ8 1/20 0.35
▸ HDAC3 O15379 1/20 0.35
▸ HDAC4 P56524 1/20 0.35
▸ HDAC1 Q13547 1/20 0.35
▸ HDAC7 Q8WUI4 1/20 0.35
▸ HDAC2 Q92769 1/20 0.35
▸ HDAC10 Q969S8 1/20 0.35
▸ HDAC11 Q96DB2 1/20 0.35
▸ HDAC8 Q9BY41 1/20 0.35
▸ HDAC6 Q9UBN7 1/20 0.35
▸ HDAC9 Q9UKV0 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
SCHEMBL24520454 1.00 FAP (0.47) FAPFURINNPY5RNPY4RNPY1R
SCHEMBL21649698 0.94 FURIN (0.44) FAPFURINNPY5RNPY4RNPY1R
SCHEMBL22336596 0.94 FURIN (0.44) FAPFURINNPY5RNPY4RNPY1R
SCHEMBL27432486 0.94 FAP (0.46) FAPFURINNPY5RNPY4RNPY1R
SCHEMBL16273799 0.94 NPY4R (0.46) FAPFURINNPY5RNPY4RNPY1R
SCHEMBL21416485 0.94 FAP (0.44) FAPFURINNPY5RNPY4RNPY1R
SCHEMBL16266215 0.94 FAP (0.44) FAPFURINNPY5RNPY4RNPY1R
SCHEMBL16266184 0.94 FAP (0.44) FAPFURINNPY5RNPY4RNPY1R
SCHEMBL22952275 0.94 FAP (0.44) FAPFURINNPY5RNPY4RNPY1R
SCHEMBL20808481 0.94 FAP (0.44) FAPFURINNPY5RNPY4RNPY1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2019232449-A9 SPLICING MODULATOR ANTIBODY-DRUG CONJUGATES AND METHODS OF USE EISAI R&D MANAGEMENT CO., LTD. (JP) 2020-09-24 — — WO disclosed
US-9803002-B2 Anti-wall teichoic antibodies and conjugates Genentench, Inc. (US) 2017-10-31 — — US disclosed
US-9669106-B2 Conjugate of monomethyl auristatin F and trastuzumab and its use for the treatment of cancer PIERRE FABRE MEDICAMENT (FR) 2017-06-06 — — US disclosed
US-20170112891-A1 HINDERED DISULFIDE DRUG CONJUGATES GENENTECH INC (US) 2017-04-27 — — US disclosed
US-20150366985-A1 ANTI-WALL TEICHOIC ANTIBODIES AND CONJUGATES GENENTECH, INC. (US) 2015-12-24 — — US disclosed
US-20140356375-A1 ANTI-WALL TEICHOIC ANTIBODIES AND CONJUGATES GENENTECH, INC. (US) 2014-12-04 — — US disclosed
US-20140356376-A1 ANTI-WALL TEICHOIC ANTIBODIES AND CONJUGATES GENENTECH, INC. (US) 2014-12-04 — — US disclosed
US-20120148608-A1 MONOMETHYLVALINE COMPOUNDS CAPABLE OF CONJUGATION TO LIGANDS SEATTLE GENETICS, INC. (US) 2012-06-14 — — US disclosed
US-20120034247-A1 MONOMETHYLVALINE COMPOUNDS CAPABLE OF CONJUGATION TO LIGANDS SEATTLE GENETICS, INC. (US) 2012-02-09 — — US disclosed
US-7851437-B2 monoclonal antibody conjugated with peptide drug such as dolastatin derivative SEATTLE GENETICS INC. (US) 2010-12-14 — — US disclosed
US-7829531-B2 Drug conjugates and their use for treating cancer, an autoimmune disease or an infectious disease SEATTLE GENETICS INC. (US) 2010-11-09 — — US disclosed
US-20100062008-A1 monoclonal antibody conjugated with peptide drug such as dolastatin derivative SEATTLE GENETICS, INC. (US) 2010-03-11 — — US disclosed
US-20090324621-A1 monoclonal antibody conjugated with peptide drug such as dolastatin derivative SEATTLE GENETICS, INC. (US) 2009-12-31 — — 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 (8 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-20150366985-A1 ANTI-WALL TEICHOIC ANTIBODIES AND CONJUGATES STT3A, STT3B, DDOST FAP 4221/4885FURIN 1993/4885NPY5R 3485/4885
US-20100062008-A1 monoclonal antibody conjugated with peptide drug such as dolastatin derivative DAD1, DDOST, STT3A FAP 2680/4885FURIN 342/4885NPY5R 2056/4885
US-20140356375-A1 ANTI-WALL TEICHOIC ANTIBODIES AND CONJUGATES STT3A, STT3B, DDOST FAP 4221/4885FURIN 1993/4885NPY5R 3485/4885
US-20140356376-A1 ANTI-WALL TEICHOIC ANTIBODIES AND CONJUGATES STT3A, STT3B, DDOST FAP 4221/4885FURIN 1993/4885NPY5R 3485/4885
US-20120034247-A1 MONOMETHYLVALINE COMPOUNDS CAPABLE OF CONJUGATION TO LIGANDS MMAB, CAD, VIM FAP 2453/4885FURIN 410/4885NPY5R 1587/4885
US-20090324621-A1 monoclonal antibody conjugated with peptide drug such as dolastatin derivative DAD1, DDOST, STT3A FAP 2680/4885FURIN 342/4885NPY5R 2056/4885
US-20120148608-A1 MONOMETHYLVALINE COMPOUNDS CAPABLE OF CONJUGATION TO LIGANDS MMAB, CAD, VIM FAP 2453/4885FURIN 410/4885NPY5R 1587/4885
US-20170112891-A1 HINDERED DISULFIDE DRUG CONJUGATES STS, TST, SCLY FAP 2854/4885FURIN 469/4885NPY5R 2198/4885

“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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