SCHEMBL4669295

SCHEMBL4669295

C=C(C)C(=O)OC(CCCCCCC(COC(N)=O)OC(=O)C(=C)C)COC(N)=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.41
ALDH1A1 P00352 4/20 0.32
LMNA P02545 1/20 0.32
THRB P10828 1/20 0.32
ALOX15 P16050 1/20 0.31
PRKCA P17252 2/20 0.31
CHRNB2 P17787 1/20 0.31
CHRNB4 P30926 1/20 0.31
CHRNA3 P32297 1/20 0.31
CHRNA4 P43681 1/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
USP2 O75604 1/20 0.31
CYP3A4 P08684 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
TDP1 Q9NUW8 2/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2D6 P10635 1/20 0.30
PKM P14618 1/20 0.30
NPSR1 Q6W5P4 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
SCHEMBL10654449 0.91 TSHR (0.42) TSHRALDH1A1LMNATHRBALOX15
SCHEMBL730544 0.83 TSHR (0.56) TSHRALDH1A1LMNATHRBPRKCA
SCHEMBL27370383 0.83 TSHR (0.56) TSHRALDH1A1LMNATHRBPRKCA
SCHEMBL730808 0.83 TSHR (0.56) TSHRALDH1A1LMNATHRBPRKCA
SCHEMBL22207427 0.83 TSHR (0.56) TSHRALDH1A1LMNATHRBPRKCA
SCHEMBL27370395 0.83 TSHR (0.56) TSHRALDH1A1LMNATHRBPRKCA
SCHEMBL27370412 0.83 TSHR (0.56) TSHRALDH1A1LMNATHRBPRKCA
SCHEMBL8581536 0.83 TSHR (0.47) TSHRALDH1A1LMNATHRBPRKCA
SCHEMBL10752559 0.82 TSHR (0.33) TSHR
SCHEMBL8923921 0.81 TSHR (0.49) TSHRALDH1A1THRBPRKCATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1365915-A4 POLYMER GEL CONTACT MASKS AND METHODS AND MOLDS FOR MAKING SAME SURFACE LOGIX INC (US) 2008-06-25 EP disclosed
US-20040247912-A1 Polymer gel contact masks and methods and molds for making same KIM ENOCH (US) 2004-12-09 US disclosed
US-6770721-B1 PATTERNING TRANSFER ELEMENT COMPRISING CROSSLINKED HYDROXYETHYL METHACRYLATE COPOLYMER HAVING ELEVATED AND RECESSED PORTIONS; HIGH THROUGHPUT DRUG SCREENING SURFACE LOGIX, INC. 2004-08-03 US disclosed
EP-1365915-A1 POLYMER GEL CONTACT MASKS AND METHODS AND MOLDS FOR MAKING SAME Surface Logix, Inc. (US) 2003-12-03 EP disclosed
WO-2002036342-A1 POLYMER GEL CONTACT MASKS AND METHODS AND MOLDS FOR MAKING SAME SURFACE LOGIX, INC. (US) 2002-05-10 WO disclosed