SCHEMBL7706521

SCHEMBL7706521

CCCCc1c(C)c(N)cc(C)c1Nc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SKP2 Q13309 1/20 0.43
RAPGEF4 Q8WZA2 3/20 0.38
LMNA P02545 3/20 0.38
MAPT P10636 3/20 0.38
NPSR1 Q6W5P4 2/20 0.38
XBP1 P17861 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HSD17B10 Q99714 1/20 0.38
TLR7 Q9NYK1 1/20 0.37
KCNH3 Q9ULD8 1/20 0.35
PDE4A P27815 1/20 0.34
PDE4B Q07343 1/20 0.34
PDE4C Q08493 1/20 0.34
PDE4D Q08499 1/20 0.34
PDE3B Q13370 1/20 0.34
PDE3A Q14432 1/20 0.34
GAA P10253 3/20 0.34
CYP1A2 P05177 2/20 0.34
CYP2D6 P10635 2/20 0.34

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
SCHEMBL5713301 0.89 SKP2 (0.43) SKP2RAPGEF4LMNAMAPTNPSR1
SCHEMBL15854826 0.79 RAPGEF4 (0.53) SKP2RAPGEF4LMNAMAPTNPSR1
SCHEMBL21629706 0.79 HSD17B10 (0.43) LMNAMAPTNPSR1XBP1HTT
SCHEMBL27512209 0.77 MAPT (0.43) SKP2LMNAMAPTNPSR1XBP1
SCHEMBL8026165 0.74 MAPT (0.40) SKP2LMNAMAPTNPSR1XBP1
SCHEMBL28313595 0.74 MAPT (0.43) SKP2LMNAMAPTNPSR1XBP1
SCHEMBL16682976 0.73 RAPGEF4 (0.50) RAPGEF4LMNAMAPTNPSR1XBP1
SCHEMBL28292241 0.72 MAPT (0.44) LMNAMAPTNPSR1XBP1HTT
SCHEMBL7098349 0.72 MAPT (0.44) SKP2LMNAMAPTNPSR1XBP1
SCHEMBL8160614 0.71 SKP2 (0.47) SKP2MAPTNPSR1HTTHSD17B10

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
WO-1998059016-A1 COMPOSITION AND METHOD FOR INHIBITING RADICAL POLYMERISATION OF ETHYLENICALLY UNSATURATED AROMATIC MONOMERS RHODIA CHIMIE (FR) 1998-12-30 WO claimed
EP-3083276-A1 A RUBBER COMPOUND FOR TYRE PRODUCTION Bridgestone Corporation (JP) 2016-10-26 EP disclosed
WO-2015092765-A1 A RUBBER COMPOUND FOR TYRE PRODUCTION BRIDGESTONE CORPORATION (JP) 2015-06-25 WO disclosed
EP-1171803-A1 PHOTO-CURABLE POLYMER COMPOSITION AND FLEXOGRAPHIC PRINTING PLATES CONTAINING THE SAME KRATON Polymers Research B.V. (NL) 2002-01-16 EP disclosed
WO-2000041036-A1 PHOTO-CURABLE POLYMER COMPOSITION AND FLEXOGRAPHIC PRINTING PLATES CONTAINING THE SAME KRATON POLYMERS RESEARCH B.V. (NL) 2000-07-13 WO disclosed
EP-0080409-B1 FLEXIBLE ELASTOMER COMPOSITION OF EPICHLOROHYDRINE Commissariat à l'Energie Atomique (FR) 1986-02-26 EP disclosed