SCHEMBL30765655

SCHEMBL30765655

O=C(Cn1c(-c2ccccc2)ncc(NCCCO[C@@H]2CO[C@H]3[C@@H]2OC[C@H]3O)c1=O)NCc1cc2cnccc2[nH]1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
AVPR1B P47901 13/20 0.36
NTRK1 P04629 2/20 0.36
BCHE P06276 1/20 0.35
CASP1 P29466 1/20 0.35
CMA1 P23946 1/20 0.35
CTRC Q99895 1/20 0.35
NTRK3 Q16288 1/20 0.34
F2 P00734 1/20 0.34
ELANE P08246 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
SCHEMBL30766007 0.94 AVPR1B (0.37) AVPR1BNTRK1CASP1CMA1CTRC
SCHEMBL30765912 0.88 PRKAG1 (0.36) AVPR1BBCHECASP1F2ELANE
SCHEMBL30765634 0.84 CASP1 (0.42) AVPR1BNTRK1CASP1CMA1CTRC
SCHEMBL30765577 0.83 AVPR1B (0.36) AVPR1BNTRK1CASP1CMA1F2
SCHEMBL30765857 0.82 BCHE (0.41) AVPR1BBCHECASP1ELANE
SCHEMBL30765562 0.82 F2 (0.36) AVPR1BCASP1CMA1F2ELANE
SCHEMBL30766049 0.82 NTRK1 (0.43) AVPR1BNTRK1CASP1CMA1CTRC
SCHEMBL30765470 0.81 AVPR1B (0.37) AVPR1BNTRK1CASP1CMA1CTRC
Hydrochloric Acid SCHEMBL30765434 0.81 NTRK1 (0.43) AVPR1BNTRK1CASP1CMA1CTRC
SCHEMBL30765517 0.80 ELANE (0.40) AVPR1BBCHECASP1ELANE

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