SCHEMBL28010238

SCHEMBL28010238

C=CC(=O)Oc1cc(C)ccc1OCC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 6/20 0.44
▸ MAPT P10636 6/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ ATM Q13315 1/20 0.44
▸ THRB P10828 3/20 0.42
▸ THRA P10827 1/20 0.42
▸ ALDH1A1 P00352 5/20 0.41
▸ TDP1 Q9NUW8 2/20 0.41
▸ MAPK1 P28482 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ EGFR P00533 1/20 0.41
▸ KCNMA1 Q12791 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ LMNA P02545 4/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ HTT P42858 2/20 0.40
▸ HSP90AA1 P07900 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39

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
SCHEMBL28085568 0.85 KDM4E (0.51) THRBTHRAALDH1A1KDM4EPOLB
SCHEMBL27715812 0.81 THRB (0.50) L3MBTL1MAPTTHRBTHRAALDH1A1
SCHEMBL27432689 0.81 THRB (0.51) RAB9ATHRBALDH1A1MAPK1KDM4E
SCHEMBL819105 0.81 THRB (0.56) L3MBTL1MAPTTHRBTHRAALDH1A1
SCHEMBL30197447 0.81 THRB (0.56) L3MBTL1MAPTTHRBTHRAALDH1A1
SCHEMBL28326398 0.80 LMNA (0.37) L3MBTL1THRBTHRAALDH1A1TDP1
SCHEMBL10870938 0.80 THRB (0.50) RAB9ATHRBTHRAALDH1A1KDM4E
SCHEMBL39759 0.80 KMT2A (0.47) L3MBTL1MAPTRAB9AATMTHRB
SCHEMBL2317025 0.80 THRB (0.45) L3MBTL1MAPTRAB9ATHRBTHRA
SCHEMBL28119567 0.80 THRB (0.45) L3MBTL1RAB9ATHRBTHRAALDH1A1

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
CN-103547655-B Reactive mesogen based polymer particles MERCK PATENT GMBH 2015-06-03 — — CN disclosed
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