SCHEMBL21133516

SCHEMBL21133516

CC(C)(Br)C(=O)OCC(C)(COC(=O)C(C)(C)Br)C(=O)OCCNC(=O)[C@H]1C2C=CC(O2)[C@H]1C=O

nearest known ligand 0.30

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ GAA P10253 1/20 0.30
▸ MAPT P10636 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
SCHEMBL21441594 1.00 KDM4E (0.30) KDM4EALDH1A1GAAMAPT
SCHEMBL21441750 0.97 — —
SCHEMBL21133449 0.94 — —
SCHEMBL19263677 0.94 — —
SCHEMBL21133701 0.94 ALDH1A1 (0.33) KDM4EALDH1A1GAAMAPT
SCHEMBL21733114 0.92 — —
SCHEMBL15431760 0.86 ALDH1A1 (0.34) KDM4EALDH1A1GAAMAPT
SCHEMBL21133459 0.83 — —
SCHEMBL21733107 0.82 — —
SCHEMBL21133704 0.81 — —

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2558538-B1 HIGH MOLECULAR WEIGHT ZWITTERION-CONTAINING POLYMERS KODIAK SCIENCES INC (US) 2019-07-03 — — EP disclosed
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