SCHEMBL23452545

SCHEMBL23452545

C[C@H](NC(=O)O)C(=O)NCc1cc2cnccc2[nH]1

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ F2 P00734 4/20 0.61
▸ MASP2 O00187 2/20 0.55
▸ F3 P13726 3/20 0.42
▸ F10 P00742 1/20 0.42
▸ PRSS1 P07477 1/20 0.42
▸ PRSS2 P07478 1/20 0.42
▸ PRSS3 P35030 1/20 0.42
▸ NAMPT P43490 11/20 0.42
▸ CYP2C9 P11712 2/20 0.42
▸ DAO P14920 1/20 0.39
▸ HDAC3 O15379 2/20 0.39
▸ HDAC1 Q13547 2/20 0.39
▸ HDAC2 Q92769 2/20 0.39
▸ NCOR2 Q9Y618 2/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL23452548 1.00 F2 (0.61) F2MASP2F3F10PRSS1
Trifluoroacetic Acid SCHEMBL23452474 0.95 F2 (0.57) F2MASP2F3F10PRSS1
SCHEMBL30387402 0.85 F2 (0.54) F2MASP2NAMPTCYP2C9SMN1; SMN2
SCHEMBL28593575 0.85 F2 (0.54) F2MASP2NAMPTCYP2C9SMN1; SMN2
SCHEMBL23478384 0.85 F2 (0.54) F2MASP2NAMPTCYP2C9SMN1; SMN2
SCHEMBL23461311 0.84 F2 (0.52) F2MASP2F3F10PRSS1
SCHEMBL23461309 0.84 F2 (0.52) F2MASP2F3F10PRSS1
SCHEMBL23452339 0.84 F2 (0.48) F2NAMPTCYP2C9DAOHDAC3
Trifluoroacetic Acid SCHEMBL30632844 0.83 F2 (0.53) F2MASP2NAMPT
Trifluoroacetic Acid SCHEMBL23452218 0.81 F2 (0.50) F2MASP2F3F10PRSS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240092788-A1 MASP-2 INHIBITORS AND METHODS OF USE OMEROS CORPORATION (US) 2024-03-21 — — US disclosed
US-11807641-B2 MASP-2 inhibitors and methods of use OMEROS CORPORATION (US) 2023-11-07 — — US disclosed
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
WO-2021113682-A1 MASP-2 INHIBITORS AND METHODS OF USE OMEROS CORPORATION (US) 2021-06-10 — — WO disclosed
US-20210171531-A1 MASP-2 INHIBITORS AND METHODS OF USE OMEROS CORPORATION 2021-06-10 — — 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-20210171531-A1 MASP-2 INHIBITORS AND METHODS OF USE MASP2, METAP2, SPINT2 F2 4221/4885MASP2 1/4885F3 3993/4885
US-11584714-B2 MASP-2 inhibitors and methods of use MASP2, METAP2, SPINT2 F2 4188/4885MASP2 1/4885F3 3968/4885
US-11807641-B2 MASP-2 inhibitors and methods of use MASP2, METAP2, SPINT2 F2 4221/4885MASP2 1/4885F3 3993/4885
US-20230145071-A1 MASP-2 INHIBITORS AND METHODS OF USE MASP2, METAP2, SPINT2 F2 4188/4885MASP2 1/4885F3 3968/4885
US-20240092788-A1 MASP-2 INHIBITORS AND METHODS OF USE MASP2, METAP2, SPINT2 F2 4221/4885MASP2 1/4885F3 3993/4885

“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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