SCHEMBL6428055

SCHEMBL6428055

CCC(C)c1ccccc1COC(=O)NC(OC(N)=O)c1cc(C)cc(C)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.35
NPC1 O15118 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CTSL P07711 2/20 0.34
CTSB P07858 2/20 0.34
CTSS P25774 2/20 0.34
CYP3A4 P08684 2/20 0.33
CYP2D6 P10635 2/20 0.33
CYP2C9 P11712 2/20 0.33
CYP2C19 P33261 2/20 0.33
CYP1A2 P05177 1/20 0.33
HPGD P15428 1/20 0.33
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
LMNA P02545 2/20 0.33
TACR1 P25103 2/20 0.32
TSHR P16473 2/20 0.32
OPRK1 P41145 1/20 0.32
CTSK P43235 2/20 0.32
ALOX15 P16050 1/20 0.32

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
SCHEMBL6428053 0.78 TACR1 (0.42) TACR1TSHR
SCHEMBL2131771 0.76 TSHR (0.47) SMN1; SMN2CYP2D6CYP1A2LMNATSHR
SCHEMBL23488987 0.69 TSHR (0.49) SMN1; SMN2CYP3A4CYP2C19CYP1A2LMNA
Fenobucarb SCHEMBL7946601 0.69 ALDH1A1 (0.44) SMN1; SMN2CYP1A2KMT2ALMNATSHR
SCHEMBL204644 0.64 TSHR (0.49) CYP2D6CYP2C9CYP2C19CYP1A2HPGD
SCHEMBL17208244 0.64 CYP1A2 (0.42) SMN1; SMN2CYP2D6CYP1A2LMNA
SCHEMBL9571993 0.63 TSHR (0.53) TSHRHTTL3MBTL1
SCHEMBL29029884 0.62 ALDH1A1 (0.42) RAB9ANPC1SMN1; SMN2CYP3A4CYP2D6
SCHEMBL10178554 0.62 TSHR (0.52) TSHRHTTL3MBTL1
SCHEMBL9496936 0.62 NLRP3 (0.43) SMN1; SMN2CYP1A2LMNAL3MBTL1

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-8304047-B2 Insecticide migrates through a central layer to the surface of the outer layer which includes a surface ultraviolet radation (UV) protector such as a hindered amine light stabilizer (HALS) to minimize the UV damage induced on the insecticide; use as e.g. animal collars, tent material, wall coverings VESTERGAARD FRANDSEN SA (CH) 2012-11-06 US disclosed
US-20050089657-A1 Laminated insecticide dispenser VESTERGAARD FRANDSEN SA (CH) 2005-04-28 US disclosed