SCHEMBL8547481

SCHEMBL8547481

C=CC(=O)NCC/C(=C\c1ccc(C)cc1)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TGM2 P21980 3/20 0.43
▸ LMNA P02545 3/20 0.40
▸ MAPT P10636 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ SMN1; SMN2 Q16637 3/20 0.37
▸ RAB9A P51151 2/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ ZDHHC20 Q5W0Z9 1/20 0.36
▸ ZDHHC2 Q9UIJ5 1/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ AKR1C3 P42330 1/20 0.35
▸ RECQL P46063 1/20 0.35
▸ POLB P06746 1/20 0.35

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
SCHEMBL8551807 0.86 TGM2 (0.43) TGM2LMNAMAPTALDH1A1TSHR
SCHEMBL8546509 0.85 TGM2 (0.47) TGM2LMNAMAPTALDH1A1SMN1; SMN2
SCHEMBL8555056 0.84 THRB (0.43) TGM2ALDH1A1SMN1; SMN2RAB9ANPC1
SCHEMBL8554406 0.83 ACACB (0.43) LMNAMAPTALDH1A1SMN1; SMN2RAB9A
SCHEMBL8550291 0.83 ALDH1A1 (0.39) TGM2LMNAMAPTALDH1A1TSHR
SCHEMBL8549416 0.83 TGM2 (0.47) TGM2LMNASMN1; SMN2AKR1C3HDAC3
SCHEMBL8551274 0.82 PLAAT3 (0.41) LMNAALDH1A1SMN1; SMN2RAB9ANPC1
SCHEMBL8553499 0.82 TGM2 (0.48) TGM2LMNAMAPTALDH1A1MAPK1
SCHEMBL9408933 0.80 PYGL (0.50) LMNAALDH1A1MAPK1RAB9ANPC1
SCHEMBL8545460 0.80 ALDH1A1 (0.34) TGM2MAPTALDH1A1TSHRMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0611786-B1 Orientation layer for liquid crystals ROLIC AG (CH) 1999-04-14 — — EP disclosed
EP-0611786-A1 Orientation layer for liquid crystals F. HOFFMANN-LA ROCHE AG (CH) 1994-08-24 — — EP disclosed
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