SCHEMBL14460657

SCHEMBL14460657

COCOc1ccccc1-c1c2c(cc3c1CCCC3)CCCC2

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.37
DRD1 P21728 1/20 0.37
ALDH1A1 P00352 2/20 0.34
KCNN4 O15554 1/20 0.34
MAPT P10636 1/20 0.34
BRD4 O60885 3/20 0.34
NLRP3 Q96P20 1/20 0.33
EGFR P00533 1/20 0.33
RXRA P19793 1/20 0.33
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
CHEK1 O14757 1/20 0.32
AURKA O14965 1/20 0.32
DAPK3 O43293 1/20 0.32
JAK2 O60674 1/20 0.32
ABL1 P00519 1/20 0.32
NTRK1 P04629 1/20 0.32

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
SCHEMBL14460784 0.83 MEN1 (0.37) DRD2DRD1ALDH1A1MAPTLMNA
SCHEMBL14460821 0.79 MEN1 (0.31) DRD2DRD1MEN1KMT2A
SCHEMBL14460838 0.76 DRD2 (0.31) DRD2DRD1MEN1KMT2A
SCHEMBL14460792 0.76 DRD2 (0.31) DRD2DRD1MEN1KMT2A
SCHEMBL3935230 0.75 RXRA (0.50) RXRALMNASMN1; SMN2
SCHEMBL14393191 0.74 MAPT (0.38) ALDH1A1MAPTBRD4KDM4EMEN1
SCHEMBL14460615 0.74 MEN1 (0.45) MAPTBRD4RXRALMNAKDM4E
SCHEMBL6048623 0.74 KCNN4 (0.49) ALDH1A1KCNN4MAPTEGFRLMNA
SCHEMBL13045159 0.73 MEN1 (0.44) ALDH1A1MAPTBRD4RXRALMNA
SCHEMBL14460614 0.73 KMT2A (0.44) ALDH1A1MAPTBRD4RXRALMNA

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-7241714-B2 Bridged bi-aromatic catalysts, complexes, and methods of using the same SYMYX TECHNOLOGIES, INC. (US) 2007-07-10 US disclosed