SCHEMBL23452429

SCHEMBL23452429

O=C(O)NCc1[nH]c2ccncc2c1F

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 3/20 0.40
▸ FEN1 P39748 1/20 0.38
▸ HTR6 P50406 2/20 0.38
▸ MAPT P10636 5/20 0.38
▸ PARP1 P09874 1/20 0.37
▸ NAMPT P43490 3/20 0.36
▸ HSD17B10 Q99714 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ MAPK14 Q16539 1/20 0.35
▸ CYP2C9 P11712 1/20 0.34
▸ KIF11 P52732 1/20 0.34

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
SCHEMBL23478372 0.81 NAMPT (0.43) HTR6NAMPT
SCHEMBL30765522 0.79 FAAH (0.40) HTR6MAPTCYP2C9
Trifluoroacetic Acid SCHEMBL23452232 0.76 HTR6 (0.42) ACHEFEN1HTR6MAPTPARP1
SCHEMBL23491339 0.75 L3MBTL1 (0.41) MAPT
SCHEMBL23478373 0.74 HTR6 (0.51) ACHEFEN1HTR6MAPTPARP1
SCHEMBL23473995 0.69 ACHE (0.51) ACHEFEN1HTR6MAPTPARP1
SCHEMBL23452339 0.69 F2 (0.48) NAMPTCYP2C9
SCHEMBL27140579 0.69 SMN1; SMN2 (0.45) MAPTHSD17B10
SCHEMBL30997382 0.68 NAMPT (0.54) NAMPTHSD17B10NPSR1CYP2C9
SCHEMBL30765895 0.66 NAMPT (0.43) HTR6MAPTPARP1NAMPT

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
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
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 (3 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 ACHE 2723/4885FEN1 2348/4885HTR6 4242/4885
US-11807641-B2 MASP-2 inhibitors and methods of use MASP2, METAP2, SPINT2 ACHE 2723/4885FEN1 2348/4885HTR6 4242/4885
US-20240092788-A1 MASP-2 INHIBITORS AND METHODS OF USE MASP2, METAP2, SPINT2 ACHE 2723/4885FEN1 2348/4885HTR6 4242/4885

“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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