SCHEMBL31252194

SCHEMBL31252194

COc1cc(-c2cc(Cl)ccc2-n2cc(C(F)F)nn2)ccn1

nearest known ligand 0.45

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ F11 P03951 20/20 0.45
▸ KLKB1 P03952 18/20 0.45
▸ CYP3A4 P08684 2/20 0.45

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
SCHEMBL30995011 0.85 F11 (0.43) F11KLKB1CYP3A4
SCHEMBL24633365 0.85 F11 (0.43) F11KLKB1CYP3A4
SCHEMBL24633397 0.83 F11 (0.43) F11KLKB1CYP3A4
SCHEMBL16971567 0.83 F11 (0.43) F11KLKB1CYP3A4
SCHEMBL24633281 0.82 F11 (0.50) F11KLKB1CYP3A4
SCHEMBL31544734 0.82 F11 (0.42) F11KLKB1CYP3A4
SCHEMBL30995026 0.81 F11 (0.44) F11KLKB1
SCHEMBL29227917 0.79 CNR1 (0.42) F11KLKB1CYP3A4
SCHEMBL30995053 0.77 F11 (0.45) F11KLKB1
SCHEMBL29227939 0.77 F11 (0.45) F11KLKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4737457-A1 POLYSUBSTITUTED MACROCYCLIC COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF Shenzhen Salubris Pharmaceuticals Co., Ltd. (CN) 2026-05-06 — — EP disclosed
CN-119894901-A Polysubstituted macrocyclic compound, and preparation method and application thereof 深圳信立泰药业股份有限公司 2025-04-25 — — CN disclosed
WO-2025002297-A1 POLYSUBSTITUTED MACROCYCLIC COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF 深圳信立泰药业股份有限公司 2025-01-02 — — WO disclosed
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