SCHEMBL24266348

SCHEMBL24266348

C=C(c1cc(Br)c(OC(C)=O)c(Br)c1)c1c(C(C)Br)oc2c(O)c(O)c(O)c(O)c12

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 2/20 0.32
▸ PREP P48147 2/20 0.32
▸ CELA1 Q9UNI1 1/20 0.32
▸ THRA P10827 1/20 0.31
▸ THRB P10828 1/20 0.31
▸ EYA3 Q99504 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
SCHEMBL24266787 0.90 EYA3 (0.36) KDRPREPCELA1THRATHRB
SCHEMBL26211199 0.79 CYP2C19 (0.41) THRATHRBEYA3
SCHEMBL24267353 0.79 ALDH1A1 (0.39) EYA3
SCHEMBL25719653 0.78 EYA3 (0.34) KDRPREPCELA1THRATHRB
SCHEMBL24103740 0.74 CYP2C19 (0.32) KDRPREPCELA1EYA3
SCHEMBL22072519 0.73 TTR (0.46) THRBEYA3
SCHEMBL22072522 0.70 EYA3 (0.45) THRBEYA3
SCHEMBL25815021 0.68 EYA3 (0.60) THRBEYA3
SCHEMBL24267018 0.68 EYA3 (0.36) EYA3
SCHEMBL25816065 0.68 CYP2C19 (0.30) —

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-3957629-A1 PROCESS FOR MAKING DEUTERATED HYDROXY-BENZBROMARONE AND INTERMEDIATES THEREOF Arthrosi Therapeutics, Inc. (US) 2022-02-23 — — EP disclosed
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