SCHEMBL6556003

SCHEMBL6556003

O=C[CH]CCC(=O)Oc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.46
PRSS1 P07477 1/20 0.45
PRSS2 P07478 1/20 0.45
PRSS3 P35030 1/20 0.45
EGFR P00533 1/20 0.44
ERBB2 P04626 1/20 0.44
ALDH1A1 P00352 3/20 0.44
MAPT P10636 2/20 0.44
CYP19A1 P11511 1/20 0.44
HSD17B10 Q99714 2/20 0.43
LMNA P02545 1/20 0.43
HTT P42858 1/20 0.43
ELANE P08246 1/20 0.40
TSHR P16473 1/20 0.39
ATM Q13315 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
HPGD P15428 2/20 0.37
AKT1 P31749 1/20 0.37
ALOX15 P16050 2/20 0.37

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
SCHEMBL6131625 0.85 KMT2A (0.49) KMT2APRSS1PRSS2PRSS3EGFR
SCHEMBL43742 0.80 KMT2A (0.61) KMT2APRSS1PRSS2PRSS3EGFR
SCHEMBL6591141 0.80 PRSS1 (0.46) KMT2APRSS1PRSS2PRSS3EGFR
SCHEMBL114036 0.80 PRSS1 (0.46) KMT2APRSS1PRSS2PRSS3EGFR
SCHEMBL7692366 0.80 KMT2A (0.48) KMT2APRSS1PRSS2PRSS3EGFR
SCHEMBL10959282 0.79 PRSS1 (0.49) KMT2APRSS1PRSS2PRSS3EGFR
SCHEMBL15870693 0.79 KMT2A (0.54) KMT2APRSS1PRSS2PRSS3EGFR
SCHEMBL10000490 0.79 PRSS1 (0.49) KMT2APRSS1PRSS2PRSS3EGFR
SCHEMBL30593894 0.78 KMT2A (0.59) KMT2APRSS1PRSS2PRSS3EGFR
SCHEMBL7275147 0.77 KMT2A (0.57) KMT2APRSS1PRSS2PRSS3EGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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