SCHEMBL18879752

SCHEMBL18879752

CN1CCOCCOCCN(C)CCOc2cc(F)ccc2OCC1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.46
PKM P14618 4/20 0.44
PKLR P30613 3/20 0.44
RIPK1 Q13546 2/20 0.43
LTA4H P09960 1/20 0.42
MAPT P10636 3/20 0.42
LMNA P02545 1/20 0.42
BLM P54132 1/20 0.42
CYP2C19 P33261 1/20 0.42
HPGD P15428 1/20 0.41
KDM4E B2RXH2 2/20 0.41
GAA P10253 1/20 0.41
AKR1B1 P15121 1/20 0.41
CHRM2 P08172 1/20 0.40
CHRM1 P11229 1/20 0.40
CHRM3 P20309 1/20 0.40
ALDH1A1 P00352 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
TP53 P04637 1/20 0.40
ALDH3A1 P30838 1/20 0.40

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
SCHEMBL18072184 0.87 MAPT (0.44) HTTPKMPKLRRIPK1LTA4H
SCHEMBL14803381 0.87 MAPT (0.44) HTTPKMPKLRRIPK1LTA4H
SCHEMBL18879751 0.82 SMN1; SMN2 (0.43) HTTLTA4HMAPTLMNAKDM4E
SCHEMBL18879757 0.82 SMN1; SMN2 (0.43) HTTLTA4HMAPTLMNAKDM4E
SCHEMBL2924947 0.76 CTNNB1 (0.53) HTTPKMPKLRMAPTLMNA
SCHEMBL18071258 0.74 PRKDC (0.41) PKMPKLRLTA4HMAPTHPGD
SCHEMBL30507863 0.73 CTNNB1 (0.46) PKMPKLRMAPTKDM4EALDH1A1
SCHEMBL20867781 0.73 KDM4E (0.59) HTTPKMPKLRMAPTLMNA
SCHEMBL20348516 0.73 ALDH1A1 (0.50) HTTPKMPKLRRIPK1AKR1B1
SCHEMBL27352624 0.72 SMN1; SMN2 (0.52) HTTLMNAKDM4EGAASMN1; SMN2

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-9655982-B2 Formation and uses of europium complexes WAYNE STATE UNIVERSITY (US) 2017-05-23 US disclosed