SCHEMBL27276128

SCHEMBL27276128

C=Cc1c(Oc2cccc(C(=N)N)c2)ccc2[nH]ccc12

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 11/20 0.44
▸ F2 P00734 7/20 0.43
▸ PRSS1 P07477 7/20 0.41
▸ PRSS2 P07478 1/20 0.41
▸ PRSS3 P35030 1/20 0.41
▸ RHEB Q15382 1/20 0.41
▸ FURIN P09958 1/20 0.38

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
SCHEMBL30967836 1.00 F10 (0.44) F10F2PRSS1PRSS2PRSS3
SCHEMBL29237722 0.82 F10 (0.56) F10F2PRSS1PRSS2PRSS3
SCHEMBL30217325 0.82 F10 (0.56) F10F2PRSS1PRSS2PRSS3
SCHEMBL29237351 0.81 F10 (0.46) F10F2PRSS1PRSS2PRSS3
SCHEMBL30938228 0.81 F10 (0.46) F10F2PRSS1PRSS2PRSS3
SCHEMBL30285660 0.81 F10 (0.46) F10F2PRSS1PRSS2PRSS3
SCHEMBL29336712 0.81 F10 (0.46) F10F2PRSS1PRSS2PRSS3
SCHEMBL29336701 0.80 F10 (0.47) F10F2PRSS1PRSS2PRSS3
SCHEMBL29237564 0.79 BRD4 (0.44) RHEB
SCHEMBL30967796 0.79 BRD4 (0.44) RHEB

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
CN-118201919-A Indole compounds and methods of use 健赞公司 2024-06-14 — — CN disclosed
WO-2024054840-A1 MACROCYCLIC COMPOUNDS, COMPOSITIONS, AND METHODS OF USING THEREOF SIONNA THERAPEUTICS (US) 2024-03-14 — — WO disclosed
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