SCHEMBL8506986

SCHEMBL8506986

ClCC1(CCl)C=Cc2ccccc2C1c1cccc2ccccc12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 7/20 0.36
KDM1A O60341 1/20 0.35
ADRA1D P25100 1/20 0.34
ADRA1A P35348 1/20 0.34
ADRA1B P35368 1/20 0.34
DRD2 P14416 1/20 0.34
IDO1 P14902 1/20 0.33
SLC6A2 P23975 3/20 0.33
SLC6A3 Q01959 3/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
KDM4E B2RXH2 1/20 0.33
TDP2 O95551 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
ALOX12 P18054 1/20 0.33
MAPK1 P28482 1/20 0.33
CASP3 P42574 1/20 0.33
HTT P42858 1/20 0.33
GALK1 P51570 1/20 0.33

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
SCHEMBL4480218 0.85 SLC6A4 (0.36) SLC6A4KDM1AADRA1DADRA1AADRA1B
SCHEMBL11614041 0.80 KDM1A (0.38) SLC6A4KDM1AADRA1DADRA1AADRA1B
SCHEMBL5248281 0.80 KDM1A (0.38) SLC6A4KDM1AADRA1DADRA1AADRA1B
SCHEMBL2155195 0.80 KDM1A (0.43) SLC6A4KDM1AADRA1DADRA1AADRA1B
SCHEMBL7775994 0.77 KDM1A (0.38) SLC6A4KDM1ADRD2IDO1SLC6A2
SCHEMBL10476854 0.77 KDM1A (0.38) SLC6A4KDM1AADRA1DADRA1AADRA1B
SCHEMBL7999943 0.75 KDM1A (0.39) SLC6A4KDM1ADRD2IDO1SLC6A2
SCHEMBL20597643 0.73 HSD11B1 (0.37) SLC6A4KDM1ADRD2IDO1SLC6A2
SCHEMBL14931728 0.73 IDO1 (0.36) SLC6A4KDM1ADRD2IDO1L3MBTL1
SCHEMBL391322 0.72 EGFR (0.35) SLC6A4KDM1ADRD2IDO1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0675095-B1 Process for preparing 2,2'-bis(halogenomethyl)-1,1'-binaphthalene HOECHST AG (DE) 1999-03-24 EP disclosed
EP-0675095-A1 Process for preparing 2,2'-bis(halogenomethyl)-1,1'-binaphthalene HOECHST AKTIENGESELLSCHAFT (DE) 1995-10-04 EP disclosed