SCHEMBL9152183

SCHEMBL9152183

Oc1ccccc1OCCCCl

nearest known ligand 0.72

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.72
JAK2 O60674 1/20 0.72
LMNA P02545 1/20 0.72
MAPT P10636 1/20 0.72
DRD2 P14416 1/20 0.51
DRD4 P21917 1/20 0.51
DRD3 P35462 1/20 0.51
APP P05067 1/20 0.47
TSHR P16473 2/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
TP53 P04637 1/20 0.46
HPGD P15428 3/20 0.42
NPC1 O15118 1/20 0.42
ALDH1A1 P00352 1/20 0.42
RAB9A P51151 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
ATM Q13315 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
Methane SCHEMBL7356487 0.98 GAA (0.69) GAAJAK2LMNAMAPTDRD2
Alcohol SCHEMBL1545296 0.94 GAA (0.64) GAAJAK2LMNAMAPTDRD2
Methyl Alcohol SCHEMBL1545298 0.94 GAA (0.64) GAAJAK2LMNAMAPTDRD2
SCHEMBL9150153 0.92 GAA (0.67) GAAJAK2LMNAMAPTDRD2
SCHEMBL2234017 0.91 GAA (0.72) GAAJAK2LMNAMAPTDRD2
SCHEMBL9045649 0.89 GAA (0.82) GAAJAK2LMNAMAPTDRD2
SCHEMBL5621969 0.89 GAA (0.82) GAAJAK2LMNAMAPTDRD2
SCHEMBL24011910 0.86 GAA (0.78) GAAJAK2LMNAMAPTDRD2
SCHEMBL9123832 0.86 GAA (0.78) GAAJAK2LMNAMAPTDRD2
SCHEMBL2637278 0.86 GAA (0.95) GAAJAK2LMNAMAPTDRD2

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-0638064-A1 SUBSTITUTED 1,1,2-TRIPHENYLBUTENES AND THEIR USE IN THE TREATMENT AND DIAGNOSIS OF CANCER. BRITISH TECH GROUP (GB) 1995-02-15 EP disclosed
WO-1993022275-A1 SUBSTITUTED 1,1,2-TRIPHENYLBUTENES AND THEIR USE IN THE TREATMENT AND DIAGNOSIS OF CANCER BRITISH TECHNOLOGY GROUP LTD (GB) 1993-11-11 WO disclosed