SCHEMBL7781763

SCHEMBL7781763

CCCCCC(CCCCC)(c1ccccc1)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 4/20 0.55
ESR2 Q92731 4/20 0.55
SIGMAR1 Q99720 3/20 0.42
GAA P10253 1/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
ATM Q13315 1/20 0.40
KCNN4 O15554 1/20 0.40
EBP Q15125 1/20 0.40
KIF11 P52732 3/20 0.39
LTA4H P09960 1/20 0.38
SCN5A Q14524 1/20 0.37
SCN9A Q15858 1/20 0.37

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
SCHEMBL10448023 0.98 ESR1 (0.53) ESR1ESR2SIGMAR1GAAMEN1
SCHEMBL8978824 0.98 ESR1 (0.53) ESR1ESR2SIGMAR1GAAMEN1
SCHEMBL4740369 0.98 ESR1 (0.53) ESR1ESR2SIGMAR1GAAMEN1
SCHEMBL8158952 0.98 ESR1 (0.59) ESR1ESR2SIGMAR1GAAMEN1
SCHEMBL17923963 0.96 ESR1 (0.52) ESR1ESR2SIGMAR1GAAMEN1
SCHEMBL7543600 0.93 ESR1 (0.63) ESR1ESR2SIGMAR1MEN1KMT2A
SCHEMBL4740387 0.89 ESR1 (0.59) ESR1ESR2MEN1KMT2AKCNN4
SCHEMBL1000400 0.89 ESR1 (0.46) ESR1ESR2SIGMAR1GAAMEN1
Hydrochloric Acid SCHEMBL7850978 0.87 ESR1 (0.57) ESR1ESR2MEN1KMT2AKCNN4
SCHEMBL11298326 0.86 ESR1 (0.47) ESR1ESR2SIGMAR1GAAMEN1

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
EP-1128959-A1 A FLEXIBLE MAT FOR ABSORBING LIQUIDS COMPRISING POLYMERIC FOAM MATERIALS The Procter & Gamble Company (US) 2001-09-05 EP disclosed
WO-2000029209-A1 A FLEXIBLE MAT FOR ABSORBING LIQUIDS COMPRISING POLYMERIC FOAM MATERIALS THE PROCTER & GAMBLE COMPANY (US) 2000-05-25 WO disclosed