SCHEMBL3845944

SCHEMBL3845944

C(=C/c1cc(/C=C/c2ccccc2)cc(C23CC4CC(CC(C4)C2C2C4CC5CC(C4)CC2(c2cc(/C=C/c4ccccc4)cc(/C=C/c4ccccc4)c2)C5)C3)c1)\c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 3/20 0.36
GRIN2D O15399 3/20 0.36
GRIN3B O60391 3/20 0.36
GRIN1 Q05586 3/20 0.36
GRIN2A Q12879 3/20 0.36
GRIN2B Q13224 3/20 0.36
GRIN2C Q14957 3/20 0.36
GRIN3A Q8TCU5 3/20 0.36
CHRNA7 P36544 1/20 0.36
LMNA P02545 1/20 0.35
GAA P10253 1/20 0.35
GABBR2 O75899 1/20 0.35
GABRB1 P18505 1/20 0.35
GABRB2 P47870 1/20 0.35
GABBR1 Q9UBS5 1/20 0.35
HPGD P15428 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
RARA P10276 1/20 0.33
RARB P10826 1/20 0.33
RARG P13631 1/20 0.33

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
SCHEMBL3845948 1.00 SIGMAR1 (0.36) SIGMAR1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL3841222 0.82
SCHEMBL3841226 0.82
SCHEMBL3842477 0.78
SCHEMBL3842496 0.78 GRIN2D (0.39) SIGMAR1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL3842495 0.78 GRIN2D (0.39) SIGMAR1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL3845676 0.73 APP (0.35) CHRNA7LMNACHRNB2CHRNB4CHRNA3
SCHEMBL3850620 0.72 GABBR2 (0.38) SIGMAR1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL3850618 0.72 GABBR2 (0.38) SIGMAR1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL3849981 0.71 GRIN2D (0.49) SIGMAR1GRIN2DGRIN3BGRIN1GRIN2A

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-20090318610-A1 ORGANIC INSULATING MATERIALS, VARNISHES FOR ORGANIC INSULATING FILM EMPLOYING THEM, ORGANIC INSULATING FILMS AND SEMICONDUCTOR DEVICES SUMITOMO BAKELITE CO., LTD (JP) 2009-12-24 US disclosed
EP-2117009-A1 ORGANIC INSULATING MATERIAL, VARNISH FOR ORGANIC INSULATING FILM USING THE SAME, ORGANIC INSULATING FILM AND SEMICONDUCTOR DEVICE Sumitomo Bakelite Co., Ltd. (JP) 2009-11-11 EP disclosed