SCHEMBL9717818

SCHEMBL9717818

CCC(OC(=O)c1c(I)cc(I)c(N)c1I)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.50
CYP2C9 P11712 2/20 0.50
CHRM1 P11229 1/20 0.50
TBXA2R P21731 1/20 0.50
PDE4A P27815 1/20 0.50
ADRA1A P35348 1/20 0.50
CYP1A2 P05177 1/20 0.50
HIF1A Q16665 1/20 0.50
TDP1 Q9NUW8 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
PPARG P37231 1/20 0.31
PPARA Q07869 1/20 0.31
SIRT5 Q9NXA8 1/20 0.30

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
SCHEMBL10932897 0.87 LMNA (0.43) LMNACYP2C9CHRM1TBXA2RPDE4A
SCHEMBL9717831 0.86 LMNA (0.42) LMNACYP2C9CHRM1TBXA2RPDE4A
SCHEMBL9387753 0.74 CFTR (0.41) LMNACYP2C9CHRM1TBXA2RPDE4A
SCHEMBL9717912 0.72 LMNA (0.41) LMNACYP2C9CHRM1TBXA2RPDE4A
SCHEMBL9717766 0.72 LMNA (0.39) LMNACYP2C9CHRM1TBXA2RPDE4A
SCHEMBL9717764 0.71 LMNA (0.38) LMNACYP2C9CHRM1TBXA2RPDE4A
SCHEMBL9717761 0.70 LMNA (0.37) LMNACYP2C9CHRM1TBXA2RPDE4A
SCHEMBL124763 0.69 TSHR (0.46) LMNACYP2C9CHRM1TBXA2RPDE4A
SCHEMBL29394151 0.69 TSHR (0.46) LMNACYP2C9CHRM1TBXA2RPDE4A
SCHEMBL11821639 0.69 SERPINE1 (0.40) LMNACYP2C9CHRM1TBXA2RPDE4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0233376-B1 RADIOPAQUE THERMOPLASTIC RESIN-SILICONE NETWORK RESIN COMPOSITIONS AND MEDICAL-SURGICAL TUBINGS PREPARED THEREFROM Becton, Dickinson and Company (US) 1992-01-22 EP claimed
EP-0233376-A1 Radiopaque thermoplastic resin-silicone network resin compositions and medical-surgical tubings prepared therefrom Becton, Dickinson and Company (US) 1987-08-26 EP claimed
EP-0233376-B1 RADIOPAQUE THERMOPLASTIC RESIN-SILICONE NETWORK RESIN COMPOSITIONS AND MEDICAL-SURGICAL TUBINGS PREPARED THEREFROM Becton, Dickinson and Company (US) 1992-01-22 EP disclosed
EP-0233376-A1 Radiopaque thermoplastic resin-silicone network resin compositions and medical-surgical tubings prepared therefrom Becton, Dickinson and Company (US) 1987-08-26 EP disclosed