SCHEMBL11501156

SCHEMBL11501156

C=CCNC(CCC)(C(=O)O)N(C)C

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.33
MAPK1 P28482 1/20 0.33
ALDH1A1 P00352 1/20 0.32
GAA P10253 1/20 0.32
HPGD P15428 1/20 0.32

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
SCHEMBL5109142 0.77 ALDH1A1 (0.36) MAPK1ALDH1A1
SCHEMBL27676756 0.75 EPHX1 (0.37)
Ammonia Solution, Strong SCHEMBL27475159 0.73 EPHX1 (0.36)
SCHEMBL7600761 0.72 KMT2A (0.33) FAAHMAPK1
SCHEMBL5109283 0.70 TGFBR1 (0.32)
SCHEMBL438355 0.67 TSHR (0.39) FAAHMAPK1ALDH1A1HPGD
SCHEMBL6170683 0.66 TSHR (0.35) FAAHMAPK1ALDH1A1GAAHPGD
SCHEMBL11663791 0.66 MAPK1 (0.36) FAAHMAPK1ALDH1A1GAAHPGD
SCHEMBL463384 0.66 BBOX1 (0.33) FAAH
SCHEMBL7597236 0.66 HMGCR (0.34)

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4204879-A AZINE, AZO, OR ANO-METHINE DYES WILLIAMS (HOUNSLOW) LIMITED (GB) 1980-05-27 US disclosed