SCHEMBL6290189

SCHEMBL6290189

CCCCNC(=O)NCC(CNC)(CNC)CNC

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 8/20 0.57
MMP2 P08253 2/20 0.41
MMP1 P03956 1/20 0.41
ACHE P22303 1/20 0.40
EPHX2 P34913 3/20 0.40
POLB P06746 1/20 0.38

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
SCHEMBL6285625 0.93 EPHX1 (0.53) EPHX1MMP2MMP1ACHEEPHX2
SCHEMBL6289560 0.85 EPHX1 (0.57) EPHX1MMP2MMP1ACHEEPHX2
SCHEMBL6287780 0.84 EPHX1 (0.55) EPHX1MMP2MMP1ACHEEPHX2
SCHEMBL6289685 0.84 EPHX1 (0.55) EPHX1MMP2MMP1ACHEEPHX2
SCHEMBL6289592 0.84 EPHX1 (0.55) EPHX1MMP2MMP1ACHEEPHX2
SCHEMBL6287612 0.83 EPHX1 (0.59) EPHX1MMP2MMP1ACHEPOLB
SCHEMBL6285467 0.80 ALDH1A1 (0.37) EPHX1MMP2MMP1EPHX2
SCHEMBL6283759 0.80 EPHX1 (0.55) EPHX1MMP2MMP1ACHEEPHX2
SCHEMBL320112 0.79 EPHX1 (0.85) EPHX1MMP2MMP1ACHE
SCHEMBL6287138 0.79 EPHX1 (0.53) EPHX1MMP2MMP1ACHEEPHX2

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