SCHEMBL8176941

SCHEMBL8176941

CCCCCCCCCCCCCCN(C(=O)CCCCCCCCCCC)[C@@]1(NC(=O)CNC(=O)CN)C[C@@H](O)[C@H](O)[C@@H](CO)O1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 3/20 0.32
▸ GJB2 P29033 1/20 0.31
▸ GBA1 P04062 1/20 0.30

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
SCHEMBL8177815 1.00 EPHX2 (0.32) EPHX2GJB2GBA1
SCHEMBL8181572 1.00 EPHX2 (0.32) EPHX2GJB2GBA1
SCHEMBL8181496 1.00 EPHX2 (0.32) EPHX2GJB2GBA1
SCHEMBL8178279 1.00 EPHX2 (0.32) EPHX2GJB2GBA1
SCHEMBL8176285 1.00 EPHX2 (0.32) EPHX2GJB2GBA1
SCHEMBL8181560 0.96 CNR1 (0.36) EPHX2
SCHEMBL8182793 0.96 CNR1 (0.36) EPHX2
SCHEMBL8178333 0.94 EPHX2 (0.33) EPHX2GJB2GBA1
SCHEMBL8170117 0.94 EPHX2 (0.33) EPHX2GJB2GBA1
SCHEMBL8182254 0.94 EPHX2 (0.33) EPHX2GJB2GBA1

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
US-6034055-A Glycosyl-amides of 2-aminoacylamino-2-deoxy-sugars BAYER AKTIENGESELLSCHAFT (DE) 2000-03-07 — — US disclosed
US-5905071-A IMMUNE SYSTEM STIMULATORS BAYER AKTIENGESELLSCHAFT (DE) 1999-05-18 — — US disclosed
EP-0716658-B1 GLYCOSYL AMIDES OF 2-AMINOACYLAMINO-2-DEOXY SUGARS BAYER AG (DE) 1997-06-04 — — EP disclosed
Send feedback