SCHEMBL13782147

SCHEMBL13782147

Ic1ccccc1[C@H]1C=CC=CC1

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GAPDH P04406 1/20 0.31
HSPA1A P0DMV8 1/20 0.31
HSPA8 P11142 1/20 0.31
PTPN7 P35236 1/20 0.31

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
SCHEMBL13782207 1.00 GAPDH (0.31) GAPDHHSPA1AHSPA8PTPN7
SCHEMBL30704940 0.78 HTR2C (0.40)
SCHEMBL29661182 0.78 HTR2C (0.40)
SCHEMBL12666370 0.77 CYP3A4 (0.33)
SCHEMBL28064123 0.77 KDM1A (0.41) PTPN7
SCHEMBL28084686 0.77 DPP4 (0.44)
SCHEMBL27365166 0.77 MEN1 (0.37) GAPDHHSPA1AHSPA8PTPN7
SCHEMBL16491843 0.77 KDM1A (0.40)
SCHEMBL12992673 0.77 CYP3A4 (0.33)
SCHEMBL27834350 0.77 KDM1A (0.41) PTPN7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2075309-A2 Novel organic electroluminescent compounds and organic electroluminescent device using the same Gracel Display Inc. (KR) 2009-07-01 EP disclosed