SCHEMBL2552080

SCHEMBL2552080

O=C(O)CNC(=O)CNC(=O)CCCCCN1C(=O)C=CC1=O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 7/20 0.64
PTGS2 P35354 7/20 0.64
FAAH O00519 6/20 0.50
MGLL Q99685 4/20 0.50
ALDH1A1 P00352 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
HTT P42858 2/20 0.50
HSP90AA1 P07900 1/20 0.50
TLR9 Q9NR96 1/20 0.50
LMNA P02545 1/20 0.50
TP53 P04637 1/20 0.50
MAPT P10636 1/20 0.50
PKM P14618 1/20 0.50
HPGD P15428 1/20 0.50
XBP1 P17861 1/20 0.50
MAPK1 P28482 1/20 0.50
RECQL P46063 1/20 0.50
RAB9A P51151 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
GPR35 Q9HC97 1/20 0.50

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
SCHEMBL21450341 1.00 PTGS1 (0.64) PTGS1PTGS2FAAHMGLLALDH1A1
SCHEMBL14957180 0.97 PTGS1 (0.68) PTGS1PTGS2FAAHMGLLALDH1A1
SCHEMBL27175515 0.90 PTGS1 (0.50) PTGS1PTGS2FAAHMGLLALDH1A1
SCHEMBL25873335 0.90 PTGS1 (0.57) PTGS1PTGS2FAAHMGLLALDH1A1
SCHEMBL24581267 0.88 PTGS1 (0.49) PTGS1PTGS2FAAHMGLLALDH1A1
SCHEMBL30963644 0.88 PTGS1 (0.49) PTGS1PTGS2FAAHMGLLALDH1A1
SCHEMBL31309882 0.88 PTGS1 (0.49) PTGS1PTGS2FAAHMGLLALDH1A1
SCHEMBL16485229 0.87 PTGS1 (0.54) PTGS1PTGS2FAAHMGLLALDH1A1
SCHEMBL21882943 0.87 PTGS1 (0.54) PTGS1PTGS2FAAHMGLLALDH1A1
SCHEMBL23106271 0.87 PTGS1 (0.54) PTGS1PTGS2FAAHMGLLALDH1A1

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 42 patents — showing the first 20. 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-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-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-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-9592240-B2 Targeted pyrrolobenzodiazapine conjugates SEATTLE GENETICS INC. (US) 2017-03-14 US disclosed
US-20160129013-A1 TARGETED PYRROLOBENZODIAZAPINE CONJUGATES SEAGEN INC. 2016-05-12 US disclosed
US-20160129013-A1 TARGETED PYRROLOBENZODIAZAPINE CONJUGATES SEAGEN INC. 2016-05-12 US disclosed
US-9242013-B2 Targeted pyrrolobenzodiazapine conjugates SEATTLE GENETICS INC. (US) 2016-01-26 US disclosed
US-9242013-B2 Targeted pyrrolobenzodiazapine conjugates SEATTLE GENETICS INC. (US) 2016-01-26 US disclosed
EP-2558127-A1 TARGETED PYRROLOBENZODIAZAPINE CONJUGATES Seattle Genetics, Inc. (US) 2013-02-20 EP disclosed
US-20130028919-A1 TARGETED PYRROLOBENZODIAZAPINE CONJUGATES SPIROGEN DEVELOPMENTS SÀRL (CH) 2013-01-31 US disclosed
US-20130028919-A1 TARGETED PYRROLOBENZODIAZAPINE CONJUGATES SPIROGEN DEVELOPMENTS SÀRL (CH) 2013-01-31 US disclosed
WO-2011130613-A1 TARGETED PYRROLOBENZODIAZAPINE CONJUGATES SEATTLE GENETICS, INC. (US) 2011-10-20 WO disclosed
WO-2011130613-A1 TARGETED PYRROLOBENZODIAZAPINE CONJUGATES SEATTLE GENETICS, INC. (US) 2011-10-20 WO 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-20160129013-A1 TARGETED PYRROLOBENZODIAZAPINE CONJUGATES QDPR, SBDS, DNPEP PTGS1 4460/4885PTGS2 4243/4885FAAH 461/4885
US-12606634-B2 Antibody-pyrrolobenzodiazepine derivative conjugate which binds caludin-6 and claudin-9 SIGLEC9, DSG1, VSIG8 PTGS1 4035/4885PTGS2 4258/4885FAAH 1147/4885
US-20240299573-A1 ANTIBODY-PYRROLOBENZODIAZEPINE DERIVATIVE CONJUGATE PDCD6, EPCAM, CNTN1 PTGS1 4202/4885PTGS2 3863/4885FAAH 1914/4885
US-11628223-B2 Antibody-drug conjugates comprising substituted benzo[e]pyrrolo[1,2-α][1,4]diazepines GABRA1, GABRA4, GABRA2 PTGS1 2896/4885PTGS2 3498/4885FAAH 366/4885
US-12350344-B2 Methods of treating a tumor by administering a claudin-6 (CLDN6) or CLDN9 antibody-pyrrolobenzodiazepine derivative conjugate EPCAM, PDCD6, JUP PTGS1 2410/4885PTGS2 2064/4885FAAH 1969/4885
US-12246196-B2 Antibody-drug conjugates comprising substituted benzo[e]pyrrolo[1,2-a][1,4]diazepines CNTN1, BTN3A1, FABP6 PTGS1 3125/4885PTGS2 3653/4885FAAH 2089/4885
US-20250114647-A1 ANTIBODY-DRUG CONJUGATES COMPRISING SUBSTITUTED BENZO[e]PYRROLO[1,2-a][1,4]DIAZEPINES CNTN1, BTN3A1, FABP6 PTGS1 3123/4885PTGS2 3654/4885FAAH 2078/4885
US-20130028919-A1 TARGETED PYRROLOBENZODIAZAPINE CONJUGATES QDPR, SBDS, DNPEP PTGS1 4460/4885PTGS2 4243/4885FAAH 461/4885

“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.