SCHEMBL9486282

SCHEMBL9486282

Cc1cc(C)c(C)c(Oc2c(C)cccc2C)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.41
LMNA P02545 3/20 0.41
ALDH1A1 P00352 2/20 0.41
HPGD P15428 1/20 0.41
MAPK1 P28482 1/20 0.41
HTT P42858 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
RAPGEF4 Q8WZA2 1/20 0.39
CRHR1 P34998 1/20 0.39
GAA P10253 2/20 0.38
KMT2A Q03164 2/20 0.38
KDM4E B2RXH2 1/20 0.38
POLB P06746 1/20 0.38
APEX1 P27695 1/20 0.38
MPI P34949 1/20 0.38
RECQL P46063 1/20 0.38
NR3C1 P04150 1/20 0.38
SCN4A P35499 7/20 0.36
SCN1A P35498 2/20 0.36
SCN5A Q14524 2/20 0.36

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
SCHEMBL9487718 0.84 ALDH1A1 (0.44) MAPTLMNAALDH1A1HPGDMAPK1
SCHEMBL9487839 0.84 ALDH1A1 (0.38) MAPTLMNAALDH1A1HPGDMAPK1
SCHEMBL9488967 0.81 ALDH1A1 (0.42) MAPTLMNAALDH1A1HPGDMAPK1
SCHEMBL9487712 0.80 ALDH1A1 (0.41) MAPTLMNAALDH1A1HPGDMAPK1
SCHEMBL9487868 0.80 MEN1 (0.47) MAPTLMNAALDH1A1HPGDMAPK1
SCHEMBL9488030 0.79 KEAP1 (0.49) MAPTALDH1A1SMN1; SMN2GAAKMT2A
Water SCHEMBL11254873 0.78 ALDH1A1 (0.40) MAPTLMNAALDH1A1HPGDMAPK1
SCHEMBL5608458 0.78 TSHR (0.43) MAPTLMNAALDH1A1HTTSMN1; SMN2
SCHEMBL9485995 0.77 ALDH1A1 (0.54) MAPTLMNAALDH1A1HPGDMAPK1
SCHEMBL9488025 0.76 LTA4H (0.42) LMNAALDH1A1HTTSMN1; SMN2GAA

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