SCHEMBL20800167

SCHEMBL20800167

COC(=O)C1CCN(C(=O)CCC(=O)N[C@H](C(=O)N[C@@H](CCCNC(N)=O)C(=O)O)C(C)C)CC1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.42
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
ALDH1A1 P00352 1/20 0.38
ITGB3 P05106 1/20 0.36
ITGA2B P08514 1/20 0.36
C3AR1 Q16581 1/20 0.36
MEN1 O00255 1/20 0.35
FURIN P09958 4/20 0.35
EPHX2 P34913 3/20 0.35
POLB P06746 1/20 0.34
PRSS1 P07477 1/20 0.34
NOD1 Q9Y239 1/20 0.33
HRH1 P35367 2/20 0.33

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
SCHEMBL27094864 0.87 C3AR1 (0.38) C3AR1FURINEPHX2POLBPRSS1
SCHEMBL19432348 0.85 KMT2A (0.41) KMT2AITGB3ITGA2BFURINEPHX2
SCHEMBL22068145 0.84 C3AR1 (0.36) KMT2AITGB3ITGA2BC3AR1FURIN
SCHEMBL20800175 0.79 GNPAT (0.49) C3AR1FURINPOLBNOD1
SCHEMBL17987754 0.79 MAP1LC3B (0.37) KMT2AALDH1A1FURINHRH1
SCHEMBL29284569 0.78 NPC1 (0.41) KMT2ANPC1RAB9AALDH1A1MEN1
SCHEMBL29284586 0.78 NPC1 (0.41) KMT2ANPC1RAB9AALDH1A1MEN1
SCHEMBL29284547 0.78 NPC1 (0.41) KMT2ANPC1RAB9AALDH1A1MEN1
SCHEMBL21607789 0.77 C3AR1 (0.43) C3AR1FURINEPHX2POLBPRSS1
SCHEMBL26223141 0.77 C3AR1 (0.43) C3AR1FURINEPHX2POLBPRSS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230293536-A1 ANTI-ERBB2 ANTIBODY-DRUG CONJUGATE AND COMPOSITION THEREOF, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF SICHUAN KELUN-BIOTECH BIOPHARMACEUTICAL CO., LTD. (CN) 2023-09-21 US disclosed
US-20220008553-A1 ANTI-ERBB2 ANTIBODY-DRUG CONJUGATE AND COMPOSITION THEREOF, PREPARATION METHOD THEREFOR, AND USE THEREOF SICHUAN KELUN-BIOTECH BIOPHARMACEUTICAL CO., LTD. (CN) 2022-01-13 US disclosed
US-20210252006-A1 ANTI-ERBB2 ANTIBODY-DRUG CONJUGATE AND COMPOSITION THEREOF, PREPARATION METHOD THEREFOR, AND USE THEREOF SICHUAN KELUN-BIOTECH BIOPHARMACEUTICAL CO., LTD. (CN) 2021-08-19 US disclosed
US-20190076438-A1 ANTI-ERBB2 ANTIBODY-DRUG CONJUGATE AND COMPOSITION THEREOF, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF SICHUAN KELUN-BIOTECH BIOPHARMACEUTICAL CO., LTD. (CN) 2019-03-14 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-20190076438-A1 ANTI-ERBB2 ANTIBODY-DRUG CONJUGATE AND COMPOSITION THEREOF, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF ERBB2, ERBB3, EGFR KMT2A 1245/4885NPC1 1378/4885RAB9A 2821/4885
US-20230293536-A1 ANTI-ERBB2 ANTIBODY-DRUG CONJUGATE AND COMPOSITION THEREOF, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF ERBB2, ERBB3, EGFR KMT2A 1248/4885NPC1 1352/4885RAB9A 2750/4885
US-20210252006-A1 ANTI-ERBB2 ANTIBODY-DRUG CONJUGATE AND COMPOSITION THEREOF, PREPARATION METHOD THEREFOR, AND USE THEREOF ERBB2, EGFR, ERBB3 KMT2A 1249/4885NPC1 1704/4885RAB9A 1837/4885
US-20220008553-A1 ANTI-ERBB2 ANTIBODY-DRUG CONJUGATE AND COMPOSITION THEREOF, PREPARATION METHOD THEREFOR, AND USE THEREOF ERBB2, EGFR, ERBB3 KMT2A 1017/4885NPC1 1637/4885RAB9A 2175/4885

“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.