SCHEMBL22283040

SCHEMBL22283040

C=CCOC(=O)N[C@@H](C(=O)N[C@@H](C)C(=O)Nc1ccc(CO)cc1)C(C)C

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 2/20 0.40
▸ HTT P42858 1/20 0.39
▸ KMT2A Q03164 4/20 0.39
▸ MEN1 O00255 3/20 0.39
▸ LMNA P02545 1/20 0.39
▸ SMN1; SMN2 Q16637 4/20 0.36
▸ NPC1 O15118 2/20 0.36
▸ RAB9A P51151 2/20 0.36
▸ CASP3 P42574 1/20 0.36
▸ MAPT P10636 2/20 0.34
▸ ADAMTS4 O75173 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ USP2 O75604 1/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ CASP1 P29466 1/20 0.34

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
SCHEMBL22283041 1.00 BACE1 (0.40) BACE1HTTKMT2AMEN1LMNA
SCHEMBL19239617 1.00 BACE1 (0.40) BACE1HTTKMT2AMEN1LMNA
SCHEMBL12245284 1.00 BACE1 (0.40) BACE1HTTKMT2AMEN1LMNA
SCHEMBL29768879 0.91 NPC1 (0.40) KMT2AMEN1LMNASMN1; SMN2NPC1
SCHEMBL29895834 0.89 BACE1 (0.37) BACE1HTTKMT2AMEN1LMNA
SCHEMBL21858972 0.89 HTT (0.41) BACE1HTTKMT2AMEN1LMNA
SCHEMBL19211624 0.89 HTT (0.41) BACE1HTTKMT2AMEN1LMNA
SCHEMBL17196627 0.89 MEN1 (0.45) BACE1HTTKMT2AMEN1LMNA
SCHEMBL17918547 0.89 MEN1 (0.43) BACE1HTTKMT2AMEN1LMNA
SCHEMBL20149309 0.86 HTT (0.50) HTTKMT2AMEN1LMNASMN1; SMN2

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 12 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
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

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 BACE1 4189/4885HTT 4778/4885KMT2A 3198/4885
US-20240299573-A1 ANTIBODY-PYRROLOBENZODIAZEPINE DERIVATIVE CONJUGATE PDCD6, EPCAM, CNTN1 BACE1 4219/4885HTT 4084/4885KMT2A 1977/4885
US-11628223-B2 Antibody-drug conjugates comprising substituted benzo[e]pyrrolo[1,2-α][1,4]diazepines GABRA1, GABRA4, GABRA2 BACE1 855/4885HTT 3093/4885KMT2A 777/4885
US-20200261594-A1 ANTIBODY-PYRROLOBENZODIAZEPINE DERIVATIVE CONJUGATE PDCD6, EPCAM, CNTN1 BACE1 4219/4885HTT 4084/4885KMT2A 1977/4885
US-12350344-B2 Methods of treating a tumor by administering a claudin-6 (CLDN6) or CLDN9 antibody-pyrrolobenzodiazepine derivative conjugate EPCAM, PDCD6, JUP BACE1 4267/4885HTT 4354/4885KMT2A 2405/4885
US-20220125943-A1 ANTIBODY-PYRROLOBENZODIAZEPINE DERIVATIVE CONJUGATE PDCD6, EPCAM, CNTN1 BACE1 4219/4885HTT 4084/4885KMT2A 1977/4885
US-12246196-B2 Antibody-drug conjugates comprising substituted benzo[e]pyrrolo[1,2-a][1,4]diazepines CNTN1, BTN3A1, FABP6 BACE1 2666/4885HTT 3963/4885KMT2A 3107/4885
US-20230084707-A1 ANTIBODY-PYRROLOBENZODIAZEPINE DERIVATIVE CONJUGATE PDCD6, EPCAM, CNTN1 BACE1 4219/4885HTT 4084/4885KMT2A 1977/4885
US-20250114647-A1 ANTIBODY-DRUG CONJUGATES COMPRISING SUBSTITUTED BENZO[e]PYRROLO[1,2-a][1,4]DIAZEPINES CNTN1, BTN3A1, FABP6 BACE1 2696/4885HTT 3962/4885KMT2A 3126/4885
US-11583590-B2 Antibody-pyrrolobenzodiazepine derivative conjugate and method of use thereof for treating a tumor EPCAM, PDCD6, CNTN1 BACE1 4362/4885HTT 4507/4885KMT2A 2063/4885
US-20220395579-A1 ANTIBODY-PYRROLOBENZODIAZEPINE DERIVATIVE CONJUGATE PDCD6, EPCAM, CNTN1 BACE1 4219/4885HTT 4084/4885KMT2A 1977/4885

“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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