SCHEMBL4642529

SCHEMBL4642529

[CH2]CCCC(=O)Oc1ccc(C=O)cc1C

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.51
HPGD P15428 1/20 0.43
TOP2A P11388 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
ALDH1A1 P00352 6/20 0.39
AOX1 Q06278 1/20 0.39
TSHR P16473 1/20 0.38
FDPS P14324 1/20 0.37
AKR1C3 P42330 1/20 0.37
AKR1C2 P52895 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
ALOX15 P16050 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
SCHEMBL4642233 0.92 KMT2A (0.43) KMT2AHPGDTOP2AL3MBTL1ALDH1A1
SCHEMBL4644303 0.87 KMT2A (0.49) KMT2AHPGDTOP2AL3MBTL1ALDH1A1
SCHEMBL4645413 0.86 KMT2A (0.48) KMT2AHPGDTOP2AALDH1A1AOX1
SCHEMBL4641705 0.86 KMT2A (0.51) KMT2AHPGDTOP2AL3MBTL1ALDH1A1
SCHEMBL4645237 0.85 ALDH1A1 (0.42) KMT2AHPGDTOP2AL3MBTL1ALDH1A1
SCHEMBL4643811 0.85 ALDH1A1 (0.55) KMT2ATOP2AALDH1A1TSHRFDPS
SCHEMBL4644665 0.85 KMT2A (0.50) KMT2AHPGDTOP2AALDH1A1FDPS
SCHEMBL4645098 0.84 KMT2A (0.44) KMT2AHPGDL3MBTL1ALDH1A1AOX1
SCHEMBL4646913 0.83 TOP2A (0.50) KMT2AHPGDTOP2AALDH1A1AOX1
SCHEMBL4645881 0.81 ALDH1A1 (0.44) KMT2AHPGDL3MBTL1ALDH1A1AOX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1487928-B1 FILM-FORMING POLYMER AND ANTIFOULING PAINT JOTUN AS (NO) 2008-08-13 EP disclosed
EP-1487928-A1 FILM-FORMING POLYMER AND ANTIFOULING PAINT Jotun AS (NO) 2004-12-22 EP disclosed
WO-2003080747-A1 FILM-FORMING POLYMER AND ANTIFOULING PAINT JOTUN AS (NO) 2003-10-02 WO disclosed