SCHEMBL18334201

SCHEMBL18334201

O=C(NCc1ccccc1)OCCOCNCc1cccc(CNC(=O)OCCOC(=O)NCc2ccccc2)c1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PADI3 Q9ULW8 1/20 0.48
PADI4 Q9UM07 1/20 0.48
LMNA P02545 2/20 0.46
ALDH1A1 P00352 1/20 0.46
MAPT P10636 1/20 0.46
PKM P14618 1/20 0.46
ALOX12 P18054 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.44
PLAU P00749 1/20 0.43
MGLL Q99685 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
TSHR P16473 1/20 0.42
CYP2C19 P33261 1/20 0.42
PPARG P37231 1/20 0.41
BCHE P06276 1/20 0.41
ACHE P22303 1/20 0.41

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
SCHEMBL17346754 0.90 LMNA (0.56) PADI3PADI4LMNAALDH1A1MAPT
SCHEMBL18334020 0.87 PADI3 (0.43) PADI3PADI4LMNAALDH1A1MAPT
SCHEMBL17346792 0.84 TSHR (0.53) PADI3PADI4LMNAALDH1A1MAPT
SCHEMBL17864889 0.84 MGLL (0.57) PADI3PADI4LMNAALDH1A1MAPT
SCHEMBL17342588 0.84 PADI3 (0.53) PADI3PADI4LMNAALDH1A1MAPT
SCHEMBL17342582 0.82 PLAU (0.47) LMNAALDH1A1SMN1; SMN2PLAUCYP1A2
SCHEMBL17346749 0.82 TSHR (0.54) PADI3PADI4LMNAMAPTSMN1; SMN2
SCHEMBL13625200 0.81 NPC1 (0.61) PADI3PADI4LMNASMN1; SMN2MGLL
SCHEMBL17864831 0.81 PADI3 (0.48) PADI3PADI4LMNAALDH1A1MAPT
SCHEMBL17346622 0.80 TDP1 (0.51) PADI3PADI4LMNAMAPTSMN1; SMN2

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
US-10338290-B2 Cellulose ester film, polarizing plate, and liquid crystal display device FUJIFILM CORPORATION (JP) 2019-07-02 US disclosed
US-20160370522-A1 CELLULOSE ESTER FILM, POLARIZING PLATE, AND LIQUID CRYSTAL DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2016-12-22 US disclosed