SCHEMBL4644484

SCHEMBL4644484

O=C(CCCCl)C(=O)C(Cl)c1ccccc1.O=C(CCCCl)C(=O)COCc1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
NPC1 O15118 2/20 0.35
MAPT P10636 1/20 0.35
ALDH1A1 P00352 1/20 0.34
RAB9A P51151 1/20 0.34
GRM5 P41594 3/20 0.34
TACR1 P25103 2/20 0.33
TSHR P16473 1/20 0.33
CES2 O00748 1/20 0.33
CES1 P23141 1/20 0.33

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
SCHEMBL4641878 0.90 HTT (0.37) HTTSMN1; SMN2NPC1MAPTALDH1A1
SCHEMBL4643773 0.89 HTT (0.36) HTTSMN1; SMN2NPC1MAPTALDH1A1
SCHEMBL4641882 0.89 HTT (0.39) HTTSMN1; SMN2NPC1MAPTALDH1A1
SCHEMBL4643777 0.88 HTT (0.38) HTTSMN1; SMN2NPC1MAPTALDH1A1
SCHEMBL27620026 0.87 TSHR (0.44) NPC1MAPTALDH1A1RAB9AGRM5
SCHEMBL4645376 0.84 SMN1; SMN2 (0.39) SMN1; SMN2ALDH1A1TSHRCES2CES1
SCHEMBL4642836 0.83 SMN1; SMN2 (0.41) HTTSMN1; SMN2NPC1MAPTALDH1A1
SCHEMBL4645623 0.83 TSHR (0.42) NPC1MAPTALDH1A1RAB9AGRM5
SCHEMBL4642834 0.82 HTT (0.40) HTTSMN1; SMN2NPC1MAPTALDH1A1
SCHEMBL4646119 0.80 SMN1; SMN2 (0.38) SMN1; SMN2MAPTCES2CES1

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