SCHEMBL22189968

SCHEMBL22189968

NC(Cc1ccccc1-c1ccncc1)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.57
▸ KCNA5 P22460 3/20 0.54
▸ KCNH2 Q12809 2/20 0.54
▸ NOS3 P29474 3/20 0.49
▸ NOS1 P29475 3/20 0.49
▸ NOS2 P35228 3/20 0.49
▸ ALPI P09923 1/20 0.49
▸ PKM P14618 1/20 0.49
▸ PTGS1 P23219 1/20 0.49
▸ XIAP P98170 1/20 0.49
▸ SLC7A5 Q01650 1/20 0.49
▸ MAPK1 P28482 1/20 0.48
▸ TPH1 P17752 4/20 0.46
▸ KIF11 P52732 1/20 0.46
▸ KDM4E B2RXH2 1/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ LMNA P02545 1/20 0.44
▸ MPO P05164 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ TSHR P16473 1/20 0.44

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
SCHEMBL22189969 1.00 KMT2A (0.57) KMT2AKCNA5KCNH2NOS3NOS1
SCHEMBL6171071 0.89 KMT2A (0.71) KMT2ANOS3NOS1NOS2ALPI
SCHEMBL16967410 0.89 KMT2A (0.71) KMT2ANOS3NOS1NOS2ALPI
SCHEMBL19667642 0.89 KMT2A (0.71) KMT2ANOS3NOS1NOS2ALPI
SCHEMBL22190043 0.85 KCNA5 (0.63) KMT2AKCNA5KCNH2NOS3NOS1
SCHEMBL22190042 0.85 KCNA5 (0.63) KMT2AKCNA5KCNH2NOS3NOS1
SCHEMBL31631338 0.84 KMT2A (0.64) KMT2ANOS3NOS1NOS2ALPI
SCHEMBL31370463 0.82 KMT2A (0.57) KMT2ANOS3NOS1NOS2ALPI
SCHEMBL7263124 0.82 KMT2A (0.57) KMT2ANOS3NOS1NOS2ALPI
SCHEMBL14863029 0.80 KCNA5 (0.54) KMT2AKCNA5KCNH2MAPK1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12077611-B2 Cyclic peptides multimers targeting α4β7 integrin ZEALAND PHARMA A/S (DK) 2024-09-03 — — US disclosed
US-20230406884-A1 CYCLIC PEPTIDES MULTIMERS TARGETING ALPHA-4-BETA-7 INTEGRIN ZEALAND PHARMA A/S (DK) 2023-12-21 — — US disclosed
US-11713338-B2 Cyclic peptides multimers targeting α-4-β-7 integrin ZEALAND PHARMA A/S (DK) 2023-08-01 — — US disclosed
US-11111273-B2 Cyclic peptides multimers targeting alpha-4-beta-7 integrin ZEALAND PHARMA A/S (DK) 2021-09-07 — — US disclosed
US-20200216501-A1 CYCLIC PEPTIDES MULTIMERS TARGETING ALPHA-4-BETA-7 INTEGRIN ZEALAND PHARMA A/S (DK) 2020-07-09 — — 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 (5 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-11111273-B2 Cyclic peptides multimers targeting alpha-4-beta-7 integrin ITGB7, ITGB4, ITGA4 KMT2A 4390/4885KCNA5 1210/4885KCNH2 1806/4885
US-12077611-B2 Cyclic peptides multimers targeting α4β7 integrin ITGB7, ITGB4, ITGA4 KMT2A 4279/4885KCNA5 697/4885KCNH2 1559/4885
US-20200216501-A1 CYCLIC PEPTIDES MULTIMERS TARGETING ALPHA-4-BETA-7 INTEGRIN ITGB7, ITGB4, ITGA4 KMT2A 4390/4885KCNA5 1210/4885KCNH2 1806/4885
US-20230406884-A1 CYCLIC PEPTIDES MULTIMERS TARGETING ALPHA-4-BETA-7 INTEGRIN ITGB7, ITGB4, ITGA4 KMT2A 4390/4885KCNA5 1210/4885KCNH2 1806/4885
US-11713338-B2 Cyclic peptides multimers targeting α-4-β-7 integrin ITGB7, ITGB4, ITGA4 KMT2A 4318/4885KCNA5 1129/4885KCNH2 1778/4885

“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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