SCHEMBL6290403

SCHEMBL6290403

CCCCNCCCCCCNC(=O)NCCCC

nearest known ligand 0.83

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 11/20 0.83
PAOX Q6QHF9 1/20 0.57
EPHX2 P34913 6/20 0.53
ALDH1A1 P00352 1/20 0.52
TSHR P16473 1/20 0.52
CASP2 P42575 1/20 0.52

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
SCHEMBL6287471 0.98 EPHX1 (0.78) EPHX1PAOXEPHX2ALDH1A1TSHR
SCHEMBL6290149 0.94 EPHX1 (0.73) EPHX1PAOXEPHX2ALDH1A1TSHR
SCHEMBL6290112 0.93 EPHX1 (0.71) EPHX1PAOXEPHX2ALDH1A1TSHR
SCHEMBL6290324 0.91 EPHX1 (0.69) EPHX1PAOXEPHX2ALDH1A1TSHR
SCHEMBL6286349 0.91 EPHX1 (0.76) EPHX1PAOXEPHX2TSHRCASP2
SCHEMBL6284969 0.91 EPHX1 (0.68) EPHX1PAOXEPHX2ALDH1A1TSHR
SCHEMBL25227097 0.91 EPHX1 (1.00) EPHX1EPHX2CASP2
SCHEMBL8377308 0.91 EPHX1 (1.00) EPHX1EPHX2CASP2
SCHEMBL11258951 0.91 EPHX1 (1.00) EPHX1EPHX2CASP2
SCHEMBL25228476 0.91 EPHX1 (1.00) EPHX1EPHX2CASP2

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