SCHEMBL22283176

SCHEMBL22283176

CC(C)[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)N[C@@H](C)C(=O)O

nearest known ligand 0.63

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CASP3 P42574 4/20 0.63
▸ MDM4 O15151 2/20 0.48
▸ TP53 P04637 2/20 0.48
▸ KMT2A Q03164 2/20 0.47
▸ PIN1 Q13526 1/20 0.45
▸ EPHX2 P34913 1/20 0.45

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
SCHEMBL29415586 1.00 CASP3 (0.63) CASP3MDM4TP53KMT2APIN1
SCHEMBL29423393 1.00 CASP3 (0.63) CASP3MDM4TP53KMT2APIN1
SCHEMBL29493550 1.00 CASP3 (0.63) CASP3MDM4TP53KMT2APIN1
SCHEMBL2558967 1.00 CASP3 (0.63) CASP3MDM4TP53KMT2APIN1
SCHEMBL15480253 1.00 CASP3 (0.63) CASP3MDM4TP53KMT2APIN1
SCHEMBL8904188 1.00 CASP3 (0.63) CASP3MDM4TP53KMT2APIN1
SCHEMBL29415589 1.00 CASP3 (0.63) CASP3MDM4TP53KMT2APIN1
SCHEMBL16401903 1.00 CASP3 (0.63) CASP3MDM4TP53KMT2APIN1
SCHEMBL2558970 1.00 CASP3 (0.63) CASP3MDM4TP53KMT2APIN1
SCHEMBL23138547 0.94 CASP3 (0.58) CASP3MDM4TP53KMT2AEPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12606634-B2 Antibody-pyrrolobenzodiazepine derivative conjugate which binds caludin-6 and claudin-9 DAIICHI SANKYO COMPANY, LIMITED (JP) 2026-04-21 — — US disclosed
US-12350344-B2 Methods of treating a tumor by administering a claudin-6 (CLDN6) or CLDN9 antibody-pyrrolobenzodiazepine derivative conjugate DAIICHI SANKYO COMPANY, LIMITED (JP) 2025-07-08 — — US disclosed
US-20250114647-A1 ANTIBODY-DRUG CONJUGATES COMPRISING SUBSTITUTED BENZO[e]PYRROLO[1,2-a][1,4]DIAZEPINES DAIICHI SANKYO COMPANY, LIMITED (JP) 2025-04-10 — — US disclosed
US-12246196-B2 Antibody-drug conjugates comprising substituted benzo[e]pyrrolo[1,2-a][1,4]diazepines DAIICHI SANKYO COMPANY, LIMITED (JP) 2025-03-11 — — US disclosed
US-20240299573-A1 ANTIBODY-PYRROLOBENZODIAZEPINE DERIVATIVE CONJUGATE DAIICHI SANKYO COMPANY, LIMITED (JP) 2024-09-12 — — US disclosed
CN-116999572-A Antibody-drug conjugate, pharmaceutical composition and application thereof in preparation of drugs for treating tumors 第一三共株式会社 2023-11-07 — — CN disclosed
CN-116999573-A Antibody-drug conjugate, preparation method thereof, pharmaceutical composition and application thereof in preparation of drugs for treating tumors 第一三共株式会社 2023-11-07 — — CN disclosed
CN-117003875-A Antibody or functional fragment thereof, polynucleotide, expression vector, host cell, sugar chain reconstruction antibody, pharmaceutical composition and application 第一三共株式会社 2023-11-07 — — CN disclosed
CN-111164208-B Antibody-pyrrolobenzodiazepine derivative conjugates 第一三共株式会社 2023-08-04 — — CN disclosed
US-11628223-B2 Antibody-drug conjugates comprising substituted benzo[e]pyrrolo[1,2-α][1,4]diazepines DAIICHI SANKYO COMPANY, LIMITED (JP) 2023-04-18 — — US disclosed
US-20230084707-A1 ANTIBODY-PYRROLOBENZODIAZEPINE DERIVATIVE CONJUGATE DAIICHI SANKYO COMPANY, LIMITED (JP) 2023-03-16 — — US disclosed
US-11583590-B2 Antibody-pyrrolobenzodiazepine derivative conjugate and method of use thereof for treating a tumor DAIICHI SANKYO COMPANY, LIMITED (JP) 2023-02-21 — — US disclosed
US-20220395579-A1 ANTIBODY-PYRROLOBENZODIAZEPINE DERIVATIVE CONJUGATE DAIICHI SANKYO COMPANY, LIMITED (JP) 2022-12-15 — — US disclosed
US-20220125943-A1 ANTIBODY-PYRROLOBENZODIAZEPINE DERIVATIVE CONJUGATE DAIICHI SANKYO COMPANY, LIMITED (JP) 2022-04-28 — — US disclosed
US-20200261594-A1 ANTIBODY-PYRROLOBENZODIAZEPINE DERIVATIVE CONJUGATE DAIICHI SANKYO COMPANY, LIMITED (JP) 2020-08-20 — — US disclosed
EP-3690038-A1 ANTIBODY-PYRROLOBENZODIAZEPINE DERIVATIVE CONJUGATE DAIICHI SANKYO COMPANY, LIMITED (JP) 2020-08-05 — — EP disclosed
CN-111164208-A Antibody-pyrrolobenzodiazepine derivative conjugates 第一三共株式会社 2020-05-15 — — CN 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 (11 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-12606634-B2 Antibody-pyrrolobenzodiazepine derivative conjugate which binds caludin-6 and claudin-9 SIGLEC9, DSG1, VSIG8 CASP3 3581/4885MDM4 4566/4885TP53 4375/4885
US-20240299573-A1 ANTIBODY-PYRROLOBENZODIAZEPINE DERIVATIVE CONJUGATE PDCD6, EPCAM, CNTN1 CASP3 1239/4885MDM4 4696/4885TP53 4441/4885
US-11628223-B2 Antibody-drug conjugates comprising substituted benzo[e]pyrrolo[1,2-α][1,4]diazepines GABRA1, GABRA4, GABRA2 CASP3 4043/4885MDM4 4786/4885TP53 4566/4885
US-20200261594-A1 ANTIBODY-PYRROLOBENZODIAZEPINE DERIVATIVE CONJUGATE PDCD6, EPCAM, CNTN1 CASP3 1239/4885MDM4 4696/4885TP53 4441/4885
US-12350344-B2 Methods of treating a tumor by administering a claudin-6 (CLDN6) or CLDN9 antibody-pyrrolobenzodiazepine derivative conjugate EPCAM, PDCD6, JUP CASP3 309/4885MDM4 4232/4885TP53 736/4885
US-20220125943-A1 ANTIBODY-PYRROLOBENZODIAZEPINE DERIVATIVE CONJUGATE PDCD6, EPCAM, CNTN1 CASP3 1239/4885MDM4 4696/4885TP53 4441/4885
US-12246196-B2 Antibody-drug conjugates comprising substituted benzo[e]pyrrolo[1,2-a][1,4]diazepines CNTN1, BTN3A1, FABP6 CASP3 1452/4885MDM4 4439/4885TP53 3548/4885
US-20230084707-A1 ANTIBODY-PYRROLOBENZODIAZEPINE DERIVATIVE CONJUGATE PDCD6, EPCAM, CNTN1 CASP3 1239/4885MDM4 4696/4885TP53 4441/4885
US-20250114647-A1 ANTIBODY-DRUG CONJUGATES COMPRISING SUBSTITUTED BENZO[e]PYRROLO[1,2-a][1,4]DIAZEPINES CNTN1, BTN3A1, FABP6 CASP3 1471/4885MDM4 4440/4885TP53 3508/4885
US-11583590-B2 Antibody-pyrrolobenzodiazepine derivative conjugate and method of use thereof for treating a tumor EPCAM, PDCD6, CNTN1 CASP3 1051/4885MDM4 4186/4885TP53 1812/4885
US-20220395579-A1 ANTIBODY-PYRROLOBENZODIAZEPINE DERIVATIVE CONJUGATE PDCD6, EPCAM, CNTN1 CASP3 1239/4885MDM4 4696/4885TP53 4441/4885

“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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