SCHEMBL6286430

SCHEMBL6286430

CCNC(=O)NCC(C)O

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 3/20 0.42
MAPT P10636 1/20 0.38
CYP2D6 P10635 1/20 0.36
CYP2C19 P33261 1/20 0.36
ALDH1A1 P00352 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
TSHR P16473 1/20 0.35
MMP1 P03956 1/20 0.34
MMP2 P08253 1/20 0.34
MMP3 P08254 1/20 0.34
MMP9 P14780 1/20 0.34
MMP8 P22894 1/20 0.34
KMT2A Q03164 1/20 0.33
EPHX2 P34913 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
SCHEMBL13681843 1.00 EPHX1 (0.42) EPHX1MAPTCYP2D6CYP2C19ALDH1A1
SCHEMBL941571 0.90 EPHX1 (0.43) EPHX1MAPTCYP2D6CYP2C19ALDH1A1
SCHEMBL965868 0.83 EPHX1 (0.59) EPHX1MAPTCYP2D6CYP2C19ALDH1A1
SCHEMBL11279011 0.82 EPHX1 (0.53) EPHX1ALDH1A1SMN1; SMN2MMP1MMP2
SCHEMBL23652165 0.79 EPHX1 (0.41) EPHX1MAPTCYP2D6CYP2C19ALDH1A1
SCHEMBL6284945 0.79 EPHX1 (0.41) EPHX1MAPTCYP2D6CYP2C19ALDH1A1
SCHEMBL28293734 0.79 MMP1 (0.48) EPHX1ALDH1A1SMN1; SMN2MMP1MMP2
SCHEMBL320068 0.79
SCHEMBL6289598 0.79 EPHX1 (0.65) EPHX1SMN1; SMN2MMP1MMP2KMT2A
SCHEMBL13627727 0.78

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
EP-3109287-B1 INK COMPOSITION, INK SET AND INKJET RECORDING METHOD FUJIFILM CORP (JP) 2019-08-28 EP disclosed
US-20160333209-A1 INK COMPOSITION, INK SET, AND INK JET RECORDING METHOD FUJIFILM CORPORATION (JP) 2016-11-17 US disclosed
US-20160333209-A1 INK COMPOSITION, INK SET, AND INK JET RECORDING METHOD FUJIFILM CORPORATION (JP) 2016-11-17 US disclosed
US-6916854-B2 Heat and/or light curable films or coatings comprising polyurethanes or polyureaurethane copolymers having storage stability, used as automobile paints BASF AKTIENGESELLSCHAFT (DE) 2005-07-12 US disclosed
US-20040097642-A1 Unsaturated compounds containing carbamate terminal groups or urea terminal groups BASF AKTIENGESELLSCHAFT (DE) 2004-05-20 US disclosed