SCHEMBL6889381

SCHEMBL6889381

CCCCCCCCCCc1c[nH]c(CC)n1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.48
ALDH1A1 P00352 1/20 0.41
PKM P14618 1/20 0.41
HPGD P15428 1/20 0.41
GPR84 Q9NQS5 5/20 0.38
HRH4 Q9H3N8 1/20 0.37
HRH3 Q9Y5N1 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
SCHEMBL8858270 1.00 KCNH2 (0.48) KCNH2ALDH1A1PKMHPGDGPR84
SCHEMBL28376279 1.00 KCNH2 (0.48) KCNH2ALDH1A1PKMHPGDGPR84
SCHEMBL4055366 0.98 KCNH2 (0.46) KCNH2ALDH1A1PKMHPGDGPR84
SCHEMBL3842012 0.92 HRH3 (0.41) KCNH2ALDH1A1PKMHPGDHRH3
SCHEMBL730079 0.91 KCNH2 (0.50) KCNH2ALDH1A1PKMHPGDGPR84
SCHEMBL10697416 0.91 KCNH2 (0.50) KCNH2ALDH1A1PKMHPGDGPR84
SCHEMBL9133514 0.91 KCNH2 (0.50) KCNH2ALDH1A1PKMHPGDGPR84
SCHEMBL9817100 0.91 KCNH2 (0.50) KCNH2ALDH1A1PKMHPGDGPR84
SCHEMBL4445935 0.91 KCNH2 (0.50) KCNH2ALDH1A1PKMHPGDGPR84
SCHEMBL28413083 0.91 KCNH2 (0.50) KCNH2ALDH1A1PKMHPGDGPR84

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
WO-2004043634-A1 COPPER NANOCRYSTALS AND METHODS OF PRODUCING THE SAME WAYNE STATE UNIVERSITY (US) 2004-05-27 WO disclosed