SCHEMBL15799985

SCHEMBL15799985

Cc1cc(Cl)c(C(=O)OC(=O)C2(C)COC(c3ccccc3)(c3ccccc3)OC2)c(Cl)c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.34
NPC1 O15118 1/20 0.34
PKM P14618 1/20 0.34
CNR1 P21554 1/20 0.32
MEN1 O00255 3/20 0.32
KMT2A Q03164 3/20 0.32
HCRTR1 O43613 1/20 0.32
HCRTR2 O43614 1/20 0.32
LMNA P02545 2/20 0.31
CHRNB2 P17787 1/20 0.31
SLC6A2 P23975 1/20 0.31
CHRNB4 P30926 1/20 0.31
CHRNA3 P32297 1/20 0.31
CHRNA4 P43681 1/20 0.31
SLC6A3 Q01959 1/20 0.31
MAPT P10636 1/20 0.31
HTT P42858 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
GAA P10253 1/20 0.30
LDHA P00338 1/20 0.30

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
SCHEMBL6899970 0.92 LMNA (0.35) CNR1MEN1KMT2AHCRTR1HCRTR2
SCHEMBL1814508 0.80 MEN1 (0.42) MEN1KMT2ALMNACHRNB2SLC6A2
SCHEMBL7734302 0.75 LMNA (0.34) KMT2AHCRTR1HCRTR2LMNAMAPT
SCHEMBL1817756 0.75 KMT2A (0.40) KMT2AHCRTR1HCRTR2LMNAMAPT
SCHEMBL1818873 0.71 MAPK1 (0.41) MEN1KMT2ALMNACHRNB2SLC6A2
SCHEMBL15799984 0.71 CHRNB2 (0.39) MEN1KMT2ALMNACHRNB2SLC6A2
SCHEMBL1817884 0.65 MAPK1 (0.56) KMT2ALMNACHRNB2SLC6A2CHRNB4
SCHEMBL21319702 0.65 KMT2A (0.37) RAB9ANPC1MEN1KMT2ALMNA
SCHEMBL15373204 0.64 MAPK1 (0.52) RAB9ANPC1MEN1KMT2AHCRTR1
SCHEMBL7270762 0.62 ALDH1A1 (0.50) RAB9ANPC1PKMCNR1MEN1

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-8754207-B2 Process for the preparation of rapamycin derivatives CADILA HEALTHCARE LIMITED (IN) 2014-06-17 US disclosed