SCHEMBL8158310

SCHEMBL8158310

C=C(C)C(=O)OCCOC(=O)/C=C/c1cccc(F)c1C

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 5/20 0.42
▸ KDM4E B2RXH2 3/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ EGFR P00533 1/20 0.41
▸ ERBB2 P04626 1/20 0.41
▸ AKR1B10 O60218 7/20 0.38
▸ AKR1B1 P15121 7/20 0.38
▸ ALDH1A1 P00352 2/20 0.37
▸ HPGD P15428 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ THRB P10828 1/20 0.36

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
SCHEMBL8157427 0.95 KDM4E (0.41) ALOX5KDM4EMEN1KMT2AEGFR
SCHEMBL8150987 0.81 ALDH1A1 (0.46) ALOX5KDM4EMEN1KMT2AEGFR
SCHEMBL18373551 0.79 ALOX5 (0.44) ALOX5KDM4EMEN1KMT2AAKR1B10
SCHEMBL8157283 0.77 NFE2L2 (0.59) ALOX5KDM4EMEN1KMT2AALDH1A1
SCHEMBL8143776 0.77 MAPK1 (0.54) ALOX5KDM4EMEN1KMT2AEGFR
SCHEMBL8158313 0.76 ALOX5 (0.35) ALOX5MEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL8157078 0.76 POLB (0.56) EGFRERBB2AKR1B10AKR1B1SMN1; SMN2
SCHEMBL8152922 0.75 APP (0.47) ALOX5KDM4EMEN1KMT2AEGFR
SCHEMBL8157086 0.75 ESR1 (0.43) ALOX5KDM4EMEN1KMT2AAKR1B10
SCHEMBL3085092 0.75 AKR1B10 (0.64) ALOX5KDM4EMEN1KMT2AEGFR

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-RE36625-E Linear and cyclic polymers or oligomers having a photoreactive ethene group ROLIC AG (CH) 2000-03-21 — — US disclosed
US-5539074-A LIQUID CRYSTAL POLYMERS ON SILICA FOR LIGHT SENSITIVE ELEMENTS HOFFMANN-LA ROCHE INC. (US) 1996-07-23 — — US disclosed
Send feedback