SCHEMBL22015406

SCHEMBL22015406

CONC(C)(C)c1nc(C)c2c(C)cccn12

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 16/20 0.52
SSTR1 P30872 1/20 0.39
SSTR3 P32745 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.32
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 2/20 0.32
HPGD P15428 2/20 0.32
NPC1 O15118 1/20 0.32
GLA P06280 1/20 0.32
GAA P10253 1/20 0.32
RAB9A P51151 1/20 0.32
ATM Q13315 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
HSD17B10 Q99714 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 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
SCHEMBL22015969 0.79 SSTR4 (0.54) SSTR4SSTR1SSTR3KDM4ENPC1
SCHEMBL16255895 0.77 SSTR4 (0.48) SSTR4SSTR1SSTR3SMN1; SMN2KDM4E
SCHEMBL31740381 0.69 SSTR4 (0.45) SSTR4SSTR1SSTR3
SCHEMBL19724715 0.69 SSTR4 (1.00) SSTR4SSTR1SSTR3
SCHEMBL16252720 0.69 SSTR4 (1.00) SSTR4SSTR1SSTR3
SCHEMBL19724493 0.67 SSTR4 (0.69) SSTR4SSTR1SSTR3
SCHEMBL16255917 0.67 SSTR4 (0.69) SSTR4SSTR1SSTR3
SCHEMBL31741028 0.66 SSTR4 (0.72) SSTR4SSTR1SSTR3
SCHEMBL17763047 0.66 SSTR4 (0.89) SSTR4SSTR1SSTR3
SCHEMBL25231489 0.66 SSTR4 (0.52) SSTR4SSTR1SSTR3

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-3218372-B1 MORPHOLINE AND 1,4-OXAZEPANE AMIDES AS SOMATOSTATIN RECEPTOR SUBTYPE 4 (SSTR4) AGONISTS BOEHRINGER INGELHEIM INT (DE) 2020-05-20 EP disclosed