SCHEMBL797285

SCHEMBL797285

CCCc1cccc2cc3c(CCC)c4cc5c(CCC)c(C(=O)OC)c(C(=O)OC)c(CCC)c5cc4cc3cc12

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 18/20 0.41
MTNR1B P49286 5/20 0.38
HTR2C P28335 1/20 0.38
HTR2B P41595 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
SCHEMBL798576 0.86 LDHA (0.40) MTNR1AMTNR1B
SCHEMBL796905 0.79 MEN1 (0.44)
SCHEMBL797383 0.77 KMT2A (0.43)
SCHEMBL10079141 0.77 NCEH1 (0.45)
SCHEMBL797153 0.76 MEN1 (0.44)
SCHEMBL10079130 0.75 MEN1 (0.42)
SCHEMBL10079131 0.73 MEN1 (0.43)
SCHEMBL6364973 0.73 NR4A2 (0.46)
SCHEMBL13815350 0.72 MEN1 (0.42)
SCHEMBL24293952 0.72 CA12 (0.51)

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
EP-1262469-B1 POLYACENE DERIVATIVES AND PRODUCTION THEREOF JAPAN SCIENCE & TECH AGENCY (JP) 2012-01-11 EP claimed