SCHEMBL30765708

SCHEMBL30765708

O=C(Cn1c(-c2ccccc2)ncc(NC(=O)c2ccc(Oc3ccc(F)cc3F)cc2)c1=O)NCc1cc2cnccc2n1S(=O)(=O)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 4/20 0.39
CASP1 P29466 1/20 0.36
NTRK3 Q16288 1/20 0.35
GCK P35557 3/20 0.34
F10 P00742 1/20 0.34
ELANE P08246 7/20 0.34
MET P08581 1/20 0.33
MTNR1B P49286 1/20 0.33
KCNQ3 O43525 1/20 0.33
KCNQ2 O43526 1/20 0.33
KCNE1 P15382 1/20 0.33
KCNQ1 P51787 1/20 0.33

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
SCHEMBL30765605 0.83 HDAC1 (0.39) NTRK1CASP1ELANEMETKCNQ3
SCHEMBL30765582 0.78 KDM4C (0.42) NTRK1NTRK3MTNR1B
SCHEMBL30765506 0.78 NTRK1 (0.51) NTRK1NTRK3
SCHEMBL30765928 0.77 DGAT2 (0.44) NTRK1CASP1NTRK3ELANEMTNR1B
SCHEMBL30765788 0.74 NTRK1 (0.38) NTRK1
SCHEMBL30765974 0.73 CASP1 (0.44) NTRK1CASP1NTRK3ELANE
SCHEMBL30765852 0.70 NTRK1 (0.38) NTRK1NTRK3
SCHEMBL30765718 0.70 NTRK1 (0.45) NTRK1NTRK3MTNR1B
SCHEMBL31558568 0.69 NTRK1 (0.45) NTRK1CASP1NTRK3ELANE
SCHEMBL27144443 0.68 MAPK14 (0.34) MTNR1B

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
EP-4568666-A1 PHARMACEUTICAL COMPOUNDS FOR THE TREATMENT OF COMPLEMENT MEDIATED DISORDERS Alexion Pharmaceuticals, Inc. (US) 2025-06-18 EP disclosed
WO-2024035686-A1 PHARMACEUTICAL COMPOUNDS FOR THE TREATMENT OF COMPLEMENT MEDIATED DISORDERS ALEXION PHARMACEUTICALS, INC. (US) 2024-02-15 WO disclosed