SCHEMBL20156818

SCHEMBL20156818

C=C/C=C\C(CC)=C(/C)N1CCCCC1

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.30
NPC1 O15118 1/20 0.30
ALDH1A1 P00352 1/20 0.30
POLB P06746 1/20 0.30
RAB9A P51151 1/20 0.30
KMT2A Q03164 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL23368569 0.78 ALDH1A1 (0.32) ALDH1A1
SCHEMBL22627609 0.69
SCHEMBL6888587 0.67
SCHEMBL26080985 0.67 MMP1 (0.32) ALDH1A1
SCHEMBL18752103 0.67
SCHEMBL22620589 0.67 MMP1 (0.32) ALDH1A1
SCHEMBL17629228 0.66 ALOX5 (0.47) MEN1NPC1ALDH1A1RAB9AKMT2A
SCHEMBL15944417 0.66 ALOX5 (0.47) MEN1NPC1ALDH1A1RAB9AKMT2A
SCHEMBL25489485 0.65
SCHEMBL21646485 0.64 ALDH1A1 (0.37) MEN1ALDH1A1KMT2ASMN1; 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
WO-2018089433-A1 PHENYL mTORC INHIBITORS AND USES THEREOF NAVITOR PHARMACEUTICALS, INC. (US) 2018-05-17 WO disclosed