SCHEMBL15542804

SCHEMBL15542804

O=C(COc1ccc(CCC=NOCc2ccc3ccccc3c2)cc1)N1CCC2(CC1)CC2

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR183 P32249 4/20 0.48
NPC1 O15118 1/20 0.47
HPGD P15428 1/20 0.47
RAB9A P51151 1/20 0.47
GHSR Q92847 2/20 0.43
ALDH1A1 P00352 5/20 0.42
GLA P06280 1/20 0.42
POLB P06746 1/20 0.42
GAA P10253 3/20 0.41
LMNA P02545 2/20 0.41
MAPT P10636 2/20 0.41
ALOX15 P16050 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
USP2 O75604 2/20 0.40
TP53 P04637 2/20 0.40
KDM4E B2RXH2 1/20 0.40
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39

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
SCHEMBL15543800 0.94 GPR183 (0.46) GPR183NPC1HPGDRAB9AGHSR
SCHEMBL15543665 0.86 FKBP1A (0.47) RAB9AGHSRALDH1A1POLBGAA
SCHEMBL15543111 0.86 GHSR (0.52) GHSRALDH1A1POLBSMN1; SMN2MEN1
SCHEMBL15543282 0.84 MDH1 (0.45) GHSRALDH1A1LMNAMAPTUSP2
SCHEMBL15543553 0.81 GPR183 (0.46) GPR183NPC1HPGDRAB9AGHSR
SCHEMBL16468384 0.80 NPC1 (0.47) GPR183NPC1HPGDRAB9AGHSR
SCHEMBL15542733 0.80 NPC1 (0.47) GPR183NPC1HPGDRAB9AGHSR
SCHEMBL15542805 0.78 RAB9A (0.34) RAB9A
SCHEMBL15543143 0.77 NPC1 (0.44) GPR183NPC1HPGDRAB9AGHSR
SCHEMBL15543144 0.77 NPC1 (0.44) GPR183NPC1HPGDRAB9AGHSR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2864309-A1 COMPOUNDS FOR THE TREATMENT OF DYSLIPIDEMIA AND OTHER DISEASES Cadila Healthcare Limited (IN) 2015-04-29 EP disclosed
WO-2014002105-A1 COMPOUNDS FOR THE TREATMENT OF DYSLIPIDEMIA AND OTHER DISEASES CADILA HEALTHCARE LIMITED (IN) 2014-01-03 WO disclosed