SCHEMBL500612

SCHEMBL500612

O=C(O)CCN1CCCCC1C1CCCCC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 4/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
CYP1A2 P05177 1/20 0.42
MAPK1 P28482 1/20 0.42
HRH3 Q9Y5N1 3/20 0.40
OGFRL1 Q5TC84 1/20 0.36
USP2 O75604 1/20 0.36
POLB P06746 1/20 0.36
ALDH1A1 P00352 1/20 0.36
TERT O14746 2/20 0.36
HDAC3 O15379 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
NCOR2 Q9Y618 1/20 0.36
SCN1A P35498 1/20 0.35
SCN2A Q99250 1/20 0.35
SCN3A Q9NY46 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
LMNA P02545 2/20 0.35
MEN1 O00255 1/20 0.35

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
SCHEMBL8968613 0.80 ITGB3 (0.34) LTA4HSMN1; SMN2CYP1A2MAPK1HRH3
SCHEMBL499914 0.79 HRH3 (0.55) LTA4HHRH3POLBTERTSCN1A
Hydrochloric Acid SCHEMBL11522490 0.78 CHRM2 (0.39) LTA4HSMN1; SMN2CYP1A2MAPK1POLB
SCHEMBL3259704 0.77 LTA4H (0.43) LTA4HSMN1; SMN2CYP1A2MAPK1HRH3
SCHEMBL1082338 0.76 L3MBTL1 (0.43) SMN1; SMN2POLBTERTHDAC3HDAC8
SCHEMBL28798018 0.76 HRH3 (0.37) LTA4HSMN1; SMN2CYP1A2MAPK1HRH3
Hydrochloric Acid SCHEMBL1374273 0.75 NPC1 (0.40) LTA4HSMN1; SMN2OGFRL1NPC1RAB9A
SCHEMBL8813389 0.74 TSHR (0.40) SMN1; SMN2POLBNPC1RAB9A
SCHEMBL9489055 0.73 HRH3 (0.60) HRH3TERT
SCHEMBL12809484 0.73 HRH3 (0.60) HRH3TERT

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-8105760-B2 Patterning process and pattern surface coating composition SHIN-ETSU CHEMICAL CO., LTD. (JP) 2012-01-31 US disclosed
US-20090053657-A1 PATTERNING PROCESS AND PATTERN SURFACE COATING COMPOSITION SHIN-ETSU CHEMICAL CO., LTD. (JP) 2009-02-26 US disclosed