SCHEMBL16215340

SCHEMBL16215340

CCCCCC1CCC(C2CCC(CCc3ccc(OCC)cc3)CC2)CC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.43
MAPT P10636 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ITGB3 P05106 2/20 0.41
ITGA2B P08514 2/20 0.41
CACNA2D1 P54289 1/20 0.39
NQO1 P15559 1/20 0.39
NPC1 O15118 1/20 0.39
CASP3 P42574 1/20 0.39
SENP8 Q96LD8 1/20 0.39
NLRP3 Q96P20 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
ALDH1A1 P00352 2/20 0.38
USP2 O75604 1/20 0.38
LMNA P02545 1/20 0.38
CYP3A4 P08684 1/20 0.38
MAPK1 P28482 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
SCHEMBL10715753 1.00 RAB9A (0.43) RAB9AMAPTL3MBTL1ITGB3ITGA2B
SCHEMBL10718177 0.99 RAB9A (0.42) RAB9AMAPTL3MBTL1ITGB3ITGA2B
SCHEMBL10715782 0.99 RAB9A (0.42) RAB9AMAPTL3MBTL1ITGB3ITGA2B
SCHEMBL10717186 0.96 RAB9A (0.41) RAB9AMAPTL3MBTL1ITGB3ITGA2B
SCHEMBL8453071 0.96 RAB9A (0.46) RAB9AMAPTL3MBTL1ITGB3ITGA2B
SCHEMBL7511669 0.96 RAB9A (0.46) RAB9AMAPTL3MBTL1ITGB3ITGA2B
SCHEMBL10902889 0.94 RAB9A (0.45) RAB9AMAPTL3MBTL1ITGB3ITGA2B
SCHEMBL10479786 0.94 RAB9A (0.45) RAB9AMAPTL3MBTL1ITGB3ITGA2B
SCHEMBL10479790 0.94 RAB9A (0.45) RAB9AMAPTL3MBTL1ITGB3ITGA2B
SCHEMBL10902883 0.94 RAB9A (0.45) RAB9AMAPTL3MBTL1ITGB3ITGA2B

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
US-9175220-B2 High scattering smectic liquid crystal material and display device using the same HALATION PHOTONICS CORPORATION (CN) 2015-11-03 US disclosed
EP-2799516-A1 LIQUID CRYSTAL MATERIAL OF SMECTIC PHASE IN HIGH SCATTERING STATE AND DISPLAY DEVICE THEREOF Halation Photonics Corporation (CN) 2014-11-05 EP disclosed