SCHEMBL1572987

SCHEMBL1572987

C=C(CCCOCCOCc1ccccc1)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.45
LMNA P02545 1/20 0.45
TEAD3 Q99594 2/20 0.45
HTT P42858 1/20 0.44
TSHR P16473 1/20 0.42
NAAA Q02083 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL721274 0.97 EPHX2 (0.48) EPHX2SMN1; SMN2LMNATEAD3HTT
SCHEMBL1122001 0.92 EPHX2 (0.53) EPHX2SMN1; SMN2LMNATEAD3HTT
SCHEMBL1573160 0.90 SMN1; SMN2 (0.47) EPHX2SMN1; SMN2LMNATEAD3HTT
SCHEMBL466108 0.87 SMN1; SMN2 (0.49) EPHX2SMN1; SMN2LMNATEAD3HTT
SCHEMBL3764756 0.86 LMNA (0.50) SMN1; SMN2LMNA
SCHEMBL22367410 0.83 SMN1; SMN2 (0.53) EPHX2SMN1; SMN2LMNATEAD3HTT
SCHEMBL1572844 0.81 SMN1; SMN2 (0.48) SMN1; SMN2LMNA
SCHEMBL24674898 0.81 MAPT (0.51) EPHX2SMN1; SMN2HTTTSHRL3MBTL1
SCHEMBL24756824 0.80 SMN1; SMN2 (0.53) EPHX2SMN1; SMN2LMNATEAD3HTT
SCHEMBL291194 0.80 SMN1; SMN2 (0.57) EPHX2SMN1; SMN2TEAD3HTTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2814523-B1 OPHTHALMIC AND OTORHINOLARYNGOLOGICAL DEVICE MATERIALS CONTAINING A MULTI-ARM PEG MACROMER NOVARTIS AG (CH) 2016-04-06 EP claimed
EP-2470578-B1 OPHTHALMIC AND OTORHINOLARYNGOLOGICAL DEVICE MATERIALS NOVARTIS AG (CH) 2014-11-12 EP claimed
EP-2192933-B1 OPHTHALMIC AND OTORHINOLARYNGOLOGICAL DEVICE MATERIALS ALCON INC (CH) 2011-05-25 EP claimed
EP-2192932-B1 OPHTHALMIC AND OTORHINOLARYNGOLOGICAL DEVICE MATERIALS ALCON INC (CH) 2011-05-04 EP claimed
EP-2192931-B1 OPHTHALMIC AND OTORHINOLARYNGOLOGICAL DEVICE MATERIALS CONTAINING AN ALKYLPHENOL ETHOXYLATE ALCON INC (CH) 2011-05-04 EP claimed
EP-2192934-B1 OPHTHALMIC AND OTORHINOLARYNGOLOGICAL DEVICE MATERIALS ALCON INC (CH) 2011-05-04 EP claimed
EP-2192930-B1 OPHTHALMIC AND OTORHINOLARYNGOLOGICAL DEVICE MATERIALS CONTAINING AN ALKYL ETHOXYLATE ALCON INC (CH) 2011-04-13 EP claimed