SCHEMBL6663640

SCHEMBL6663640

CCCCN(CCCC)C(C)C=C(C)C(N)=O

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 1/20 0.35
MMP2 P08253 1/20 0.35
MMP3 P08254 1/20 0.35
MMP8 P22894 1/20 0.35
CA1 P00915 3/20 0.33
CA12 O43570 2/20 0.33
CA9 Q16790 2/20 0.33
EPHX1 P07099 1/20 0.33
CA2 P00918 1/20 0.32
FAAH O00519 3/20 0.32
ALOX5 P09917 1/20 0.31
MEN1 O00255 1/20 0.31
TP53 P04637 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2C19 P33261 1/20 0.31
SOAT1 P35610 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL6243830 0.93 EPHX1 (0.38) EPHX1FAAHMEN1TP53CYP1A2
SCHEMBL6241571 0.89 FDPS (0.35)
SCHEMBL3278812 0.86 MMP1 (0.35) MMP1MMP2MMP3MMP8CA1
SCHEMBL6240313 0.83 CA1 (0.34) MMP1MMP2MMP3MMP8CA1
SCHEMBL6664120 0.81 CA1 (0.33) MMP1MMP2MMP3MMP8CA1
SCHEMBL894270 0.81 PGR (0.32)
SCHEMBL3264022 0.81 PGR (0.32)
SCHEMBL3819594 0.81 EPHX2 (0.35) EPHX1
SCHEMBL8462509 0.79 EPHX2 (0.38) MEN1KMT2A
SCHEMBL8605170 0.78 CA1 (0.33) CA1EPHX1CA2FAAHMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4020192-A AMINO ALKYL AMIDE ACRYLIC POLYMER FUJI XEROX CO., LTD. (JA) 1977-04-26 US claimed
EP-1490427-A1 AMBIENT CURED COATINGS AND COATED RUBBER PRODUCTS THEREFROM Lord Corporation (US) 2004-12-29 EP disclosed
US-20040054041-A1 NOVEL POLYMER BINDER SYSTEMS COMPRISING IONIC LIQUIDS DEGUSSA AG (DE) 2004-03-18 US disclosed
WO-2004011536-A1 AMBIENT CURED COATINGS AND COATED RUBBER PRODUCTS THEREFROM LORD CORPORATION (US) 2004-02-05 WO disclosed
US-4020192-A AMINO ALKYL AMIDE ACRYLIC POLYMER FUJI XEROX CO., LTD. (JA) 1977-04-26 US disclosed