SCHEMBL9487542

SCHEMBL9487542

Cc1cc(C)cc(Oc2cc(C)ccc2C)c1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
NPSR1 Q6W5P4 1/20 0.46
KMT2A Q03164 2/20 0.44
MAPT P10636 1/20 0.42
HPGD P15428 1/20 0.42
ACHE P22303 1/20 0.41
MEN1 O00255 1/20 0.41
TSHR P16473 3/20 0.41
TDP1 Q9NUW8 2/20 0.40
CYP3A4 P08684 1/20 0.40
MAPK1 P28482 1/20 0.40
GAA P10253 2/20 0.39
LMNA P02545 2/20 0.39
HTT P42858 1/20 0.39
CYP2C9 P11712 1/20 0.39

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
SCHEMBL3278966 0.84 ACHE (0.50) ALDH1A1SMN1; SMN2KMT2AHPGDACHE
SCHEMBL9486947 0.83 ALDH1A1 (0.58) ALDH1A1SMN1; SMN2NPSR1KMT2AACHE
SCHEMBL13317304 0.83 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2NPSR1KMT2AMAPT
SCHEMBL5608623 0.81 SLC6A4 (0.47) SMN1; SMN2KMT2AMAPTHPGDACHE
SCHEMBL822665 0.81 TSHR (0.50) ALDH1A1SMN1; SMN2KMT2AHPGDACHE
SCHEMBL30695769 0.81 TSHR (0.50) ALDH1A1SMN1; SMN2KMT2AHPGDACHE
SCHEMBL5608759 0.79 GAA (0.55) ALDH1A1SMN1; SMN2KMT2AHPGDACHE
SCHEMBL5340839 0.78 NPSR1 (0.59) ALDH1A1SMN1; SMN2NPSR1KMT2AMAPT
SCHEMBL14021979 0.78 KMT2A (0.44) SMN1; SMN2KMT2AACHETSHRTDP1
SCHEMBL9501792 0.78 KMT2A (0.41) ALDH1A1KMT2AMAPTACHEMEN1

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
US-5250657-A Process for preparing polyarylene thioether SEISAN KAIHATSU KAGAKU KENKYUSHO (JP) 1993-10-05 US disclosed
EP-0440106-A2 Process for preparing polyarylene thioethers SEISAN KAIHATSU KAGAKU KENKYUSHO (JP) 1991-08-07 EP disclosed