SCHEMBL4646816

SCHEMBL4646816

O=C(CCCCCl)Oc1ccc(Br)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.53
MAPT P10636 3/20 0.46
HSD17B10 Q99714 3/20 0.46
ALDH1A1 P00352 2/20 0.46
LMNA P02545 1/20 0.46
HTT P42858 1/20 0.46
MEN1 O00255 2/20 0.42
PRSS1 P07477 1/20 0.41
PRSS2 P07478 1/20 0.41
PRSS3 P35030 1/20 0.41
MGLL Q99685 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
FFAR1 O14842 1/20 0.40
FFAR4 Q5NUL3 1/20 0.40
HDAC3 O15379 1/20 0.39
HDAC4 P56524 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC7 Q8WUI4 1/20 0.39
HDAC2 Q92769 1/20 0.39

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
SCHEMBL4647820 0.95 KMT2A (0.50) KMT2AMAPTHSD17B10ALDH1A1LMNA
SCHEMBL4642464 0.87 KMT2A (0.50) KMT2AMAPTHSD17B10ALDH1A1LMNA
SCHEMBL4643452 0.84 KMT2A (0.54) KMT2AMAPTHSD17B10ALDH1A1LMNA
SCHEMBL4645262 0.84 KMT2A (0.54) KMT2AMAPTHSD17B10ALDH1A1LMNA
SCHEMBL4642225 0.83 KMT2A (0.55) KMT2AMAPTHSD17B10ALDH1A1LMNA
SCHEMBL8674996 0.83 MGLL (0.59) KMT2AMAPTHSD17B10ALDH1A1LMNA
SCHEMBL28806947 0.83 KMT2A (0.53) KMT2AMAPTHSD17B10ALDH1A1LMNA
SCHEMBL4646070 0.82 KMT2A (0.51) KMT2AMAPTHSD17B10ALDH1A1LMNA
SCHEMBL4644560 0.82 KMT2A (0.51) KMT2AMAPTHSD17B10ALDH1A1LMNA
SCHEMBL7808700 0.81 MGLL (0.61) KMT2AMAPTHSD17B10ALDH1A1LMNA

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