SCHEMBL6007682

SCHEMBL6007682

Cc1ccc2c(c1)[nH]c1cc(Br)ccc12

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 4/20 0.62
RXFP1 Q9HBX9 1/20 0.48
ALDH1A1 P00352 2/20 0.48
METAP2 P50579 1/20 0.42
LMNA P02545 1/20 0.42
HPGD P15428 1/20 0.42
PIM3 Q86V86 2/20 0.41
MAPK1 P28482 1/20 0.41
PDPK1 O15530 1/20 0.41
JAK2 O60674 1/20 0.41

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
SCHEMBL20327619 0.90 KIF11 (0.59) KIF11RXFP1ALDH1A1LMNAHPGD
SCHEMBL26465252 0.90 KIF11 (0.64) KIF11RXFP1ALDH1A1LMNAHPGD
Ethane SCHEMBL29122859 0.87 METAP2 (0.48) KIF11ALDH1A1METAP2LMNAHPGD
SCHEMBL4256780 0.87 KIF11 (0.78) KIF11RXFP1ALDH1A1LMNAHPGD
SCHEMBL29518339 0.87 KIF11 (0.78) KIF11RXFP1ALDH1A1LMNAHPGD
SCHEMBL28272924 0.87 METAP2 (0.52) METAP2PIM3PDPK1JAK2
SCHEMBL181890 0.87 METAP2 (0.52) METAP2PIM3PDPK1JAK2
SCHEMBL29397381 0.87 METAP2 (0.52) METAP2PIM3PDPK1JAK2
SCHEMBL13828017 0.82 KIF11 (0.72) KIF11RXFP1LMNAPIM3
SCHEMBL10050070 0.80 CHUK (0.48) METAP2PIM3PDPK1JAK2

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
US-20060183022-A1 Electrochemical cell NEC TOKIN CORORATION (JP) 2006-08-17 US disclosed