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SCHEMBL20147100

SCHEMBL20147100

COCCC1(COC)c2cc(Br)ccc2-c2ccc(Br)cc21

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ LMNA P02545 1/20 0.32
▸ POLB P06746 1/20 0.31
▸ BACE1 P56817 2/20 0.31
▸ ALDH1A1 P00352 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ AKR1A1 P14550 1/20 0.30
▸ AKR1B1 P15121 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
SCHEMBL17361168 0.92 PDK2 (0.36) PDK2HPGDLMNAPOLBBACE1
SCHEMBL20147101 0.92 KDM4E (0.33) ALDH1A1MAPT
SCHEMBL16024284 0.84 PDK2 (0.35) PDK2HPGDLMNAPOLBALDH1A1
SCHEMBL5842438 0.84 PDK2 (0.44) PDK2HPGDLMNABACE1ALDH1A1
SCHEMBL29622840 0.83 PDK2 (0.33) PDK2HPGDLMNAPOLBBACE1
SCHEMBL4830511 0.83 PDK2 (0.33) PDK2HPGDLMNAPOLBBACE1
SCHEMBL40624 0.83 PDK2 (0.33) PDK2HPGDLMNAPOLBBACE1
SCHEMBL31564893 0.83 PDK2 (0.33) PDK2HPGDLMNAPOLBBACE1
SCHEMBL20221040 0.81 KDM4E (0.33) PDK2HPGDLMNABACE1ALDH1A1
SCHEMBL25914707 0.81 PDK2 (0.33) PDK2HPGDLMNABACE1ALDH1A1

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-2964704-B1 HETEROCYCLIC FLUORESCENT DYES AND METHOD OF PRODUCTION THEREOF BASF SE (DE) 2018-05-16 — — EP disclosed