SCHEMBL19389656

SCHEMBL19389656

CC(=O)c1cn2cc(NC(=O)c3ccc(OCCO)cc3)ccc2n1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 10/20 0.47
MAPT P10636 2/20 0.46
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
TSHR P16473 1/20 0.46
RAB9A P51151 1/20 0.46
MCL1 Q07820 1/20 0.46
HSD17B10 Q99714 1/20 0.46
EGLN1 Q9GZT9 2/20 0.45
LMNA P02545 1/20 0.45
STAT3 P40763 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
NPC1 O15118 1/20 0.44
XDH P47989 1/20 0.43
TP53 P04637 1/20 0.43

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
SCHEMBL20374925 0.90 SMN1; SMN2 (0.46) MCHR1MAPTKDM4EALDH1A1TSHR
SCHEMBL15223178 0.89 MCHR1 (0.48) MCHR1MAPTKDM4EALDH1A1TSHR
SCHEMBL19632182 0.89 MCHR1 (0.47) MCHR1MAPTKDM4EALDH1A1TSHR
SCHEMBL12392221 0.83 MCHR1 (0.43) MCHR1MAPTKDM4EALDH1A1TSHR
SCHEMBL15222292 0.83 MCHR1 (0.43) MCHR1MAPTKDM4EALDH1A1TSHR
SCHEMBL12286563 0.81 MCHR1 (0.51) MCHR1KDM4EALDH1A1RAB9AEGLN1
SCHEMBL19400520 0.80 EGLN1 (0.47) MCHR1EGLN1
SCHEMBL12286501 0.80 POLB (0.53) MCHR1MAPTRAB9AEGLN1LMNA
SCHEMBL15223174 0.80 MCHR1 (0.45) MCHR1MAPTKDM4EALDH1A1TSHR
SCHEMBL17318697 0.78 P4HTM (0.50) MCHR1KDM4EALDH1A1RAB9AEGLN1

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-2344478-B1 CC-1065 ANALOGS AND THEIR CONJUGATES SYNTARGA BV (NL) 2017-09-27 EP disclosed