SCHEMBL4644023

SCHEMBL4644023

[CH2]C(=O)Oc1cc(OC)ccc1Cl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.43
TDP1 Q9NUW8 1/20 0.43
NPC1 O15118 1/20 0.42
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42
CA14 Q9ULX7 1/20 0.42
POLB P06746 1/20 0.42
ABCG2 Q9UNQ0 2/20 0.42
MAPT P10636 4/20 0.41
KMT2A Q03164 3/20 0.41
MEN1 O00255 1/20 0.41
TYK2 P29597 1/20 0.41
TAS1R3 Q7RTX0 1/20 0.41
TAS1R1 Q7RTX1 1/20 0.41
TAS1R2 Q8TE23 1/20 0.41
LMNA P02545 1/20 0.40
HPGD P15428 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
SCHEMBL4644027 0.84 BACE1 (0.56) ALDH1A1TDP1NPC1CA12CA1
SCHEMBL4644094 0.82 CA12 (0.61) ALDH1A1NPC1CA12CA1CA2
SCHEMBL4644298 0.82 TDP1 (0.43) ALDH1A1TDP1NPC1CA12CA1
SCHEMBL4642607 0.80 MTNR1A (0.48) ALDH1A1TDP1NPC1MAPTKMT2A
SCHEMBL4644293 0.80 ALDH1A1 (0.45) ALDH1A1TDP1NPC1POLBABCG2
SCHEMBL4642055 0.80 TDP1 (0.44) ALDH1A1TDP1NPC1CA12CA1
SCHEMBL4641715 0.80 TDP1 (0.45) ALDH1A1TDP1NPC1MAPTKMT2A
SCHEMBL4641814 0.78 TDP1 (0.46) ALDH1A1TDP1NPC1MAPTKMT2A
SCHEMBL4647220 0.78 TDP1 (0.49) ALDH1A1TDP1NPC1MAPTKMT2A
SCHEMBL27901784 0.78 LMNA (0.57) ALDH1A1TDP1KMT2AMEN1LMNA

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