SCHEMBL4645154

SCHEMBL4645154

COc1cc(C=O)ccc1OC(=O)CCCl

nearest known ligand 0.79

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 6/20 0.61
ALDH1A1 P00352 5/20 0.58
TSHR P16473 1/20 0.58
FDPS P14324 1/20 0.55
KDM4E B2RXH2 1/20 0.54
MAPT P10636 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.52
AKR1C3 P42330 1/20 0.51

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
SCHEMBL4643325 0.92 TOP2A (0.59) TOP2AALDH1A1TSHRFDPSKDM4E
SCHEMBL4090523 0.91 ALDH1A1 (0.66) TOP2AALDH1A1TSHRFDPSKDM4E
SCHEMBL4644476 0.91 TOP2A (0.58) TOP2AALDH1A1TSHRFDPSKDM4E
SCHEMBL4642389 0.88 TOP2A (0.71) TOP2AALDH1A1TSHRFDPSKDM4E
SCHEMBL31096971 0.88 ALDH1A1 (0.62) TOP2AALDH1A1TSHRFDPSKDM4E
SCHEMBL31756896 0.88 TOP2A (0.63) TOP2AALDH1A1TSHRFDPSKDM4E
SCHEMBL4641527 0.87 ALDH1A1 (0.60) TOP2AALDH1A1TSHRFDPSKDM4E
SCHEMBL27603749 0.87 TOP2A (0.65) TOP2AALDH1A1TSHRFDPSKDM4E
SCHEMBL891609 0.87 ALDH1A1 (0.60) TOP2AALDH1A1TSHRFDPSKDM4E
SCHEMBL4644347 0.86 ALDH1A1 (0.58) TOP2AALDH1A1TSHRFDPSKDM4E

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