SCHEMBL6286920

SCHEMBL6286920

CCCCNC(=O)NCCCCNCC

nearest known ligand 0.72

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 8/20 0.72
TSHR P16473 1/20 0.61
PAOX Q6QHF9 1/20 0.50
CYP1A2 P05177 1/20 0.48
CYP2C19 P33261 1/20 0.48
EPHX2 P34913 7/20 0.47

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
SCHEMBL6286349 0.98 EPHX1 (0.76) EPHX1TSHRPAOXEPHX2
SCHEMBL6289611 0.91 EPHX1 (0.65) EPHX1TSHREPHX2
SCHEMBL6287471 0.91 EPHX1 (0.78) EPHX1TSHRPAOXEPHX2
SCHEMBL6290324 0.89 EPHX1 (0.69) EPHX1TSHRPAOXEPHX2
SCHEMBL6290403 0.89 EPHX1 (0.83) EPHX1TSHRPAOXEPHX2
SCHEMBL6290243 0.89 EPHX1 (0.58) EPHX1TSHRPAOXCYP1A2CYP2C19
SCHEMBL30786047 0.89 EPHX1 (0.90) EPHX1EPHX2
SCHEMBL6290149 0.88 EPHX1 (0.73) EPHX1TSHRPAOXEPHX2
SCHEMBL6287287 0.87 EPHX1 (0.61) EPHX1PAOXCYP1A2CYP2C19EPHX2
SCHEMBL6290247 0.87 EPHX1 (0.55) EPHX1TSHREPHX2

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