SCHEMBL30765632

SCHEMBL30765632

O=C(Cn1c(-c2ccccc2)ncc(NC(=O)c2ccc(Oc3ccccc3)s2)c1=O)NCc1cc2cnccc2[nH]1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CASP1 P29466 2/20 0.42
NTRK1 P04629 3/20 0.40
NTRK3 Q16288 1/20 0.38
ELANE P08246 5/20 0.36
CMA1 P23946 1/20 0.35
CTRC Q99895 1/20 0.35
F2 P00734 4/20 0.34
PRSS1 P07477 1/20 0.34
PRSS2 P07478 1/20 0.34
PRSS3 P35030 1/20 0.34
F3 P13726 1/20 0.34
AVPR1B P47901 2/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPK1 P28482 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
SCHEMBL30765974 0.88 CASP1 (0.44) CASP1NTRK1NTRK3ELANECMA1
SCHEMBL31558568 0.84 NTRK1 (0.45) CASP1NTRK1NTRK3ELANECMA1
SCHEMBL30765955 0.83 TDP1 (0.40) CASP1NTRK1NTRK3ELANECMA1
SCHEMBL30765886 0.82 CASP1 (0.40) CASP1NTRK1NTRK3ELANECMA1
SCHEMBL30765502 0.82 CASP1 (0.40) CASP1NTRK1NTRK3ELANECMA1
SCHEMBL30765634 0.81 CASP1 (0.42) CASP1NTRK1NTRK3ELANECMA1
SCHEMBL30765821 0.81 NTRK1 (0.39) CASP1NTRK1NTRK3ELANECMA1
SCHEMBL30765697 0.81 F2 (0.43) CASP1NTRK1NTRK3ELANECMA1
SCHEMBL30766005 0.81 CASP1 (0.41) CASP1NTRK1NTRK3ELANECMA1
SCHEMBL31558459 0.81 NTRK1 (0.40) NTRK1NTRK3CMA1CTRCF2

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-4568666-A1 PHARMACEUTICAL COMPOUNDS FOR THE TREATMENT OF COMPLEMENT MEDIATED DISORDERS Alexion Pharmaceuticals, Inc. (US) 2025-06-18 EP disclosed
CN-119768164-A Pharmaceutical compounds for treating complement-mediated disorders 阿雷克森制药公司 2025-04-04 CN disclosed
WO-2024035686-A1 PHARMACEUTICAL COMPOUNDS FOR THE TREATMENT OF COMPLEMENT MEDIATED DISORDERS ALEXION PHARMACEUTICALS, INC. (US) 2024-02-15 WO disclosed