SCHEMBL22190043

SCHEMBL22190043

N[C@@H](Cc1ccccc1-c1cccnc1)C(=O)O

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNA5 P22460 5/20 0.63
▸ KCNH2 Q12809 2/20 0.57
▸ KMT2A Q03164 2/20 0.54
▸ MAPK1 P28482 1/20 0.49
▸ NOS3 P29474 2/20 0.47
▸ NOS1 P29475 2/20 0.47
▸ NOS2 P35228 2/20 0.47
▸ ALPI P09923 1/20 0.46
▸ PKM P14618 1/20 0.46
▸ PTGS1 P23219 1/20 0.46
▸ XIAP P98170 1/20 0.46
▸ SLC7A5 Q01650 1/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ TPH1 P17752 2/20 0.45
▸ HSD17B10 Q99714 1/20 0.43
▸ SLC1A5 Q15758 1/20 0.43
▸ CYP11B1 P15538 1/20 0.43
▸ CYP11B2 P19099 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ MEN1 O00255 1/20 0.43

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
SCHEMBL22190042 1.00 KCNA5 (0.63) KCNA5KCNH2KMT2AMAPK1NOS3
SCHEMBL16967410 0.86 KMT2A (0.71) KMT2AMAPK1NOS3NOS1NOS2
SCHEMBL6171071 0.86 KMT2A (0.71) KMT2AMAPK1NOS3NOS1NOS2
SCHEMBL19667642 0.86 KMT2A (0.71) KMT2AMAPK1NOS3NOS1NOS2
SCHEMBL22189968 0.85 KMT2A (0.57) KCNA5KCNH2KMT2AMAPK1NOS3
SCHEMBL22189969 0.85 KMT2A (0.57) KCNA5KCNH2KMT2AMAPK1NOS3
SCHEMBL31631338 0.82 KMT2A (0.64) KMT2AMAPK1NOS3NOS1NOS2
SCHEMBL14863120 0.79 KCNA5 (0.62) KCNA5KCNH2KMT2ACYP1A2CYP11B1
SCHEMBL353300 0.78 SLC7A5 (0.56) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL7606896 0.78 SLC7A5 (0.56) ALPIPKMPTGS1XIAPSLC7A5

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 KCNA5 1210/4885KCNH2 1806/4885KMT2A 4390/4885
US-12077611-B2 Cyclic peptides multimers targeting α4β7 integrin ITGB7, ITGB4, ITGA4 KCNA5 697/4885KCNH2 1559/4885KMT2A 4279/4885
US-20200216501-A1 CYCLIC PEPTIDES MULTIMERS TARGETING ALPHA-4-BETA-7 INTEGRIN ITGB7, ITGB4, ITGA4 KCNA5 1210/4885KCNH2 1806/4885KMT2A 4390/4885
US-20230406884-A1 CYCLIC PEPTIDES MULTIMERS TARGETING ALPHA-4-BETA-7 INTEGRIN ITGB7, ITGB4, ITGA4 KCNA5 1210/4885KCNH2 1806/4885KMT2A 4390/4885
US-11713338-B2 Cyclic peptides multimers targeting α-4-β-7 integrin ITGB7, ITGB4, ITGA4 KCNA5 1129/4885KCNH2 1778/4885KMT2A 4318/4885

“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.

Send feedback