SCHEMBL7194014

SCHEMBL7194014

CCCc1ccc(CNNCc2ccc(C(C)C)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.47
NPC1 O15118 4/20 0.47
L3MBTL1 Q9Y468 2/20 0.46
ALDH1A1 P00352 2/20 0.46
KMT2A Q03164 5/20 0.46
ACACB O00763 2/20 0.42
MEN1 O00255 4/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
IDO1 P14902 2/20 0.41
ACACA Q13085 1/20 0.39
UCHL3 P15374 1/20 0.38

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
SCHEMBL597719 0.88 IDO1 (0.50) L3MBTL1ALDH1A1KMT2AACACBIDO1
SCHEMBL5275137 0.82 ACACB (0.49) RAB9ANPC1KMT2AACACBMEN1
SCHEMBL6142519 0.81 ACACB (0.49) RAB9ANPC1L3MBTL1ALDH1A1KMT2A
SCHEMBL8278011 0.78 L3MBTL1 (0.58) RAB9ANPC1L3MBTL1ALDH1A1KMT2A
SCHEMBL27708207 0.78 RAB9A (0.51) RAB9ANPC1L3MBTL1ALDH1A1KMT2A
SCHEMBL6551663 0.77 ACACB (0.42) L3MBTL1ALDH1A1KMT2AACACBIDO1
SCHEMBL426393 0.77 IDO1 (0.41) L3MBTL1ALDH1A1KMT2AACACBIDO1
SCHEMBL10729588 0.76 IDO1 (0.56) RAB9ANPC1L3MBTL1ALDH1A1KMT2A
SCHEMBL8090819 0.75 UCHL3 (0.56) RAB9ANPC1ALDH1A1SMN1; SMN2IDO1
SCHEMBL7214711 0.75 SMN1; SMN2 (0.41) RAB9ANPC1ALDH1A1SMN1; SMN2UCHL3

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-20030069127-A1 Modified particle,support, catalyst component for addition polymerization, catalyst for addition polymerization, and process for producing addition polymer SUMITOMO CHEMICAL COMPANY, LIMTED (JP) 2003-04-10 US disclosed