SCHEMBL25054009

SCHEMBL25054009

C[C@@H](CNCC(=O)N[C@@H](C)C=O)Cc1ccc(-c2ccccc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 11/20 0.45
▸ ACE P12821 6/20 0.45
▸ ACE2 Q9BYF1 4/20 0.45
▸ CPA1 P15085 3/20 0.45
▸ ALDH1A1 P00352 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ HPGD P15428 1/20 0.44
▸ ACACB O00763 1/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ MMEL1 Q495T6 1/20 0.42

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
SCHEMBL25054045 0.77 NPC1 (0.47) ALDH1A1MAPTHPGDMEN1KMT2A
SCHEMBL20881309 0.71 CTSB (0.49) —
SCHEMBL3024846 0.70 POLB (0.59) ALDH1A1MAPTHPGDMEN1KMT2A
SCHEMBL3024849 0.70 POLB (0.59) ALDH1A1MAPTHPGDMEN1KMT2A
SCHEMBL13534695 0.69 FFAR1 (0.55) MMEACEACE2CPA1MMEL1
SCHEMBL19730726 0.68 ALDH1A1 (0.50) MMEACEACE2CPA1ALDH1A1
SCHEMBL159574 0.68 TP53 (0.58) MMEACEACE2CPA1ALDH1A1
SCHEMBL8283176 0.68 TP53 (0.58) MMEACEACE2CPA1ALDH1A1
SCHEMBL23261824 0.68 FFAR1 (0.44) ACEALDH1A1HPGDACACBMEN1
SCHEMBL16932220 0.68 CAPN1 (0.52) MMEACEACE2CPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230145071-A1 MASP-2 INHIBITORS AND METHODS OF USE OMEROS CORPORATION 2023-05-11 — — US disclosed
US-11584714-B2 MASP-2 inhibitors and methods of use OMEROS CORPORATION (US) 2023-02-21 — — 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 (2 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-11584714-B2 MASP-2 inhibitors and methods of use MASP2, METAP2, SPINT2 MME 128/4885ACE 208/4885ACE2 12/4885
US-20230145071-A1 MASP-2 INHIBITORS AND METHODS OF USE MASP2, METAP2, SPINT2 MME 128/4885ACE 208/4885ACE2 12/4885

“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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