SCHEMBL2555307

SCHEMBL2555307

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nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MME P08473 5/20 0.43
ACE P12821 1/20 0.43
CPA1 P15085 1/20 0.43
ACE2 Q9BYF1 1/20 0.43
LTA4H P09960 4/20 0.39
NPSR1 Q6W5P4 1/20 0.37
ANPEP P15144 1/20 0.37
ECE1 P42892 1/20 0.37

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
SCHEMBL2555309 1.00 MME (0.43) MMEACECPA1ACE2LTA4H
SCHEMBL23071813 0.88 EPHX2 (0.39) MMEACECPA1ACE2
SCHEMBL29789543 0.84 MME (0.42) MMEACECPA1ACE2LTA4H
SCHEMBL21261787 0.82 MME (0.41) MMEACECPA1ACE2LTA4H
SCHEMBL30018433 0.82 FAAH (0.45) MMEACECPA1ACE2LTA4H
SCHEMBL964581 0.82 SMN1; SMN2 (0.47) MMEACECPA1ACE2LTA4H
SCHEMBL30628704 0.82 SMN1; SMN2 (0.47) MMEACECPA1ACE2LTA4H
SCHEMBL30569809 0.82 PSMB5 (0.44) MMEACECPA1ACE2LTA4H
SCHEMBL24191292 0.80 MME (0.37) MMEACECPA1ACE2LTA4H
SCHEMBL31303692 0.80 PSMB5 (0.43) MMEACECPA1ACE2LTA4H

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4039280-A1 TARGETED PYRROLOBENZODIAZEPINE CONJUGATES Seagen Inc. (US) 2022-08-10 EP disclosed
EP-4039280-A1 TARGETED PYRROLOBENZODIAZEPINE CONJUGATES Seagen Inc. (US) 2022-08-10 EP disclosed
EP-2558127-B1 TARGETED PYRROLOBENZODIAZEPINE CONJUGATES SEAGEN INC (US) 2022-01-19 EP disclosed
EP-2558127-B1 TARGETED PYRROLOBENZODIAZEPINE CONJUGATES SEAGEN INC (US) 2022-01-19 EP disclosed
US-20210163458-A1 NOVEL CRYPTOPHYCIN COMPOUNDS AND CONJUGATES, THEIR PREPARATION AND THEIR THERAPEUTIC USE SANOFI SA (FR) 2021-06-03 US disclosed
US-10941139-B2 Cryptophycin compounds and conjugates, their preparation and their therapeutic use SANOFI (FR) 2021-03-09 US disclosed
US-10561739-B2 Targeted pyrrolobenzodiazapine conjugates SEATTLE GENETICS INC. (US) 2020-02-18 US disclosed
US-10561739-B2 Targeted pyrrolobenzodiazapine conjugates SEATTLE GENETICS INC. (US) 2020-02-18 US disclosed
US-20190336614-A1 TARGETED PYRROLOBENZODIAZAPINE CONJUGATES SEAGEN INC. 2019-11-07 US disclosed
US-20190336614-A1 TARGETED PYRROLOBENZODIAZAPINE CONJUGATES SEAGEN INC. 2019-11-07 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 (6 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 MME 1067/4885ACE 1952/4885CPA1 2048/4885
US-20210163458-A1 NOVEL CRYPTOPHYCIN COMPOUNDS AND CONJUGATES, THEIR PREPARATION AND THEIR THERAPEUTIC USE XPOT, HCCS, COIL MME 3594/4885ACE 4806/4885CPA1 554/4885
US-10561739-B2 Targeted pyrrolobenzodiazapine conjugates QDPR, SBDS, DNPEP MME 1067/4885ACE 1952/4885CPA1 2048/4885
US-10941139-B2 Cryptophycin compounds and conjugates, their preparation and their therapeutic use XPOT, COIL, HCCS MME 3174/4885ACE 4771/4885CPA1 492/4885
US-20190336614-A1 TARGETED PYRROLOBENZODIAZAPINE CONJUGATES QDPR, SBDS, DNPEP MME 1067/4885ACE 1952/4885CPA1 2048/4885
US-20130028919-A1 TARGETED PYRROLOBENZODIAZAPINE CONJUGATES QDPR, SBDS, DNPEP MME 1067/4885ACE 1952/4885CPA1 2048/4885

“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.