SCHEMBL6283759

SCHEMBL6283759

CCCCNC(=O)NCC(CC)(CO)CO

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 8/20 0.55
ACHE P22303 2/20 0.40
MMP2 P08253 2/20 0.40
MMP1 P03956 1/20 0.40
EPHX2 P34913 2/20 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
SCHEMBL6287612 0.93 EPHX1 (0.59) EPHX1ACHEMMP2MMP1
SCHEMBL6287138 0.84 EPHX1 (0.53) EPHX1ACHEMMP2MMP1EPHX2
SCHEMBL6285625 0.84 EPHX1 (0.53) EPHX1ACHEMMP2MMP1EPHX2
SCHEMBL6284949 0.83 EPHX1 (0.52) EPHX1ACHEMMP2MMP1EPHX2
SCHEMBL6284467 0.81 ALDH1A1 (0.32) EPHX1MMP2MMP1EPHX2
SCHEMBL6289560 0.80 EPHX1 (0.57) EPHX1ACHEMMP2MMP1EPHX2
SCHEMBL6290189 0.80 EPHX1 (0.57) EPHX1ACHEMMP2MMP1EPHX2
SCHEMBL6289551 0.80 EPHX1 (0.57) EPHX1ACHEMMP2MMP1EPHX2
SCHEMBL6289645 0.80 EPHX1 (0.57) EPHX1ACHEMMP2MMP1EPHX2
SCHEMBL11011872 0.79 EPHX1 (0.61) EPHX1ACHEMMP2MMP1EPHX2

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
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