SCHEMBL22247784

SCHEMBL22247784

CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)C=N)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ALOX15 P16050 1/20 0.59
▸ ACE P12821 3/20 0.58
▸ ECE1 P42892 6/20 0.54
▸ TACR1 P25103 2/20 0.53
▸ ERAP2 Q6P179 1/20 0.52

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
SCHEMBL24301726 0.91 ACE (0.52) ALOX15ACEECE1TACR1
SCHEMBL24301727 0.91 ECE1 (0.55) ALOX15ACEECE1TACR1
SCHEMBL24301768 0.91 ALOX15 (0.53) ALOX15ACEECE1ERAP2
SCHEMBL24302063 0.91 SMN1; SMN2 (0.56) ALOX15ACETACR1
SCHEMBL24301730 0.91 SMN1; SMN2 (0.56) ALOX15ACETACR1
SCHEMBL24301938 0.90 ACE (0.55) ALOX15ACEECE1ERAP2
SCHEMBL24302207 0.90 MMP9 (0.62) ALOX15ACEECE1TACR1
SCHEMBL24301723 0.90 MAPT (0.57) TACR1
SCHEMBL24301536 0.90 BCL2A1 (0.51) ALOX15ACETACR1
SCHEMBL24301722 0.90 BCL2A1 (0.51) ALOX15ACETACR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022261117-A1 COMBINATION THERAPY WITH A DON PRODRUG AND A TIGIT INHIBITOR DRACEN PHARMACEUTICALS, INC. (US) 2022-12-15 — — WO disclosed
US-20220117938-A1 COMBINATON THERAPY WITH A DON PRODRUG AND AN IMMUNE CHECKPOINT INHIBITOR DRACEN PHARMACEUTICALS, INC. 2022-04-21 — — US disclosed
WO-2022078462-A1 NOVEL GLUTAMINE ANALOGS JACOBIO PHARMACEUTICALS CO., LTD. (CN) 2022-04-21 — — WO disclosed
WO-2020150639-A1 COMBINATON THERAPY WITH A DON PRODRUG AND AN IMMUNE CHECKPOINT INHIBITOR DRACEN PHARMACEUTICALS, INC. (US) 2020-07-23 — — 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 (1 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-20220117938-A1 COMBINATON THERAPY WITH A DON PRODRUG AND AN IMMUNE CHECKPOINT INHIBITOR PDCD1, CD274, BID ALOX15 1797/4885ACE 751/4885ECE1 2293/4885

“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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