SCHEMBL18174920

SCHEMBL18174920

CCC(C)(CC)c1nc2cc(C(C)(C)C)ccc2o1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
F2RL3 Q96RI0 4/20 0.44
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
GFER P55789 1/20 0.43
MEN1 O00255 1/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 1/20 0.41
FBP1 P09467 2/20 0.41
TRPV1 Q8NER1 2/20 0.40
HDAC3 O15379 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC2 Q92769 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
CNR2 P34972 5/20 0.37
PON1 P27169 1/20 0.35
LMNA P02545 1/20 0.34

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
SCHEMBL2706413 0.85 NPC1 (0.49) F2RL3NPC1RAB9AGFERMEN1
SCHEMBL27388560 0.81 MEN1 (0.52) F2RL3NPC1RAB9AMEN1MAPT
SCHEMBL18174916 0.81 F2RL3 (0.46) F2RL3NPC1RAB9AGFERMEN1
SCHEMBL13066947 0.80 NPC1 (0.56) NPC1RAB9AGFERMEN1MAPT
SCHEMBL30524320 0.79 NPC1 (0.44) F2RL3NPC1RAB9AGFERMEN1
SCHEMBL13066950 0.79 NPC1 (0.55) NPC1RAB9AGFERMEN1MAPT
SCHEMBL21341477 0.78 GAA (0.52) F2RL3NPC1RAB9AGFERMEN1
SCHEMBL18174915 0.77 F2RL3 (0.38) F2RL3NPC1RAB9AMEN1MAPT
SCHEMBL13081227 0.77 RAB9A (0.47) NPC1RAB9AMEN1MAPTKMT2A
SCHEMBL8221220 0.76 F2RL3 (0.42) F2RL3NPC1RAB9AGFERHDAC3

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-9477148-B1 Polymer, method for preparing the same, and a photosensitive resin composition thereof INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2016-10-25 US disclosed