SCHEMBL9160073

SCHEMBL9160073

C=CCCCCCCc1cccc2ccccc12

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 1/20 0.44
USP2 O75604 1/20 0.44
ALDH1A1 P00352 1/20 0.44
HPGD P15428 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
GPR84 Q9NQS5 1/20 0.43
SIGMAR1 Q99720 3/20 0.43
CYP1A2 P05177 2/20 0.43
CYP2C19 P33261 2/20 0.43
CYP2C9 P11712 1/20 0.43
LMNA P02545 1/20 0.43
CYP2D6 P10635 1/20 0.41
MTNR1A P48039 1/20 0.41
NQO2 P16083 1/20 0.41
SLC6A2 P23975 1/20 0.40
SLC6A4 P31645 1/20 0.40

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
SCHEMBL9403712 0.98 TLR8 (0.45) TLR8USP2ALDH1A1HPGDTDP1
SCHEMBL6028071 0.93 TLR8 (0.50) TLR8TDP1GPR84SIGMAR1CYP1A2
SCHEMBL5516425 0.85 CYP1A2 (0.48) ALDH1A1HPGDTDP1CYP1A2CYP2C19
SCHEMBL29891134 0.85 CYP1A2 (0.48) ALDH1A1HPGDTDP1CYP1A2CYP2C19
SCHEMBL9800436 0.83 CYP1A2 (0.58) TDP1GPR84SIGMAR1CYP1A2CYP2C19
SCHEMBL1612561 0.83 GPR84 (0.43) GPR84SIGMAR1CYP1A2CYP2C19CYP2C9
SCHEMBL1610678 0.83 GPR84 (0.43) GPR84SIGMAR1CYP1A2CYP2C19CYP2C9
SCHEMBL3244852 0.83 MTNR1A (0.44) TDP1GPR84SIGMAR1CYP1A2CYP2C19
SCHEMBL10481909 0.83 SIGMAR1 (0.48) GPR84SIGMAR1CYP1A2CYP2C19CYP2C9
SCHEMBL3225216 0.81 MTNR1A (0.45) TDP1GPR84SIGMAR1CYP1A2CYP2C19

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0336029-B1 Process for fluorimetric monitoring of functional coatings and structures used in the process and comprising a substrate and said functional coating MINNESOTA MINING & MFG (US) 1995-03-01 EP disclosed
US-5310604-A Composite structure for the fluorimetric monitoring of functional coatings MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1994-05-10 US disclosed
US-5270116-A Process for fluorimetric monitoring of functional coatings and compositions and fluorescent agents therefor MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1993-12-14 US disclosed
US-5087670-A Process for fluorimetric monitoring of functional coatings and compositions and fluorescent agents therefor MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1992-02-11 US disclosed
US-4978731-A CURABLE, ENCAPPED, 9-ALLYLFLUORENE-MODIFIED POLYSILOXANES; DETECTING DEFECTS, MARKINGS, THICKNESS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1990-12-18 US disclosed
US-4922113-A Process for fluorimetric monitoring of functional coatings and compositions and fluorescent agents therefor MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1990-05-01 US disclosed