SCHEMBL8457672

SCHEMBL8457672

OCCCCCCCCCOc1cc[c]cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.43
RECQL P46063 2/20 0.43
KCNA3 P22001 1/20 0.43
PRMT1 Q99873 3/20 0.41
F2 P00734 2/20 0.41
ST14 Q9Y5Y6 2/20 0.41
PLAU P00749 1/20 0.41
GAA P10253 1/20 0.41
PRMT5 O14744 1/20 0.41
NR5A1 Q13285 1/20 0.41
SLC22A2 O15244 1/20 0.41
SLC22A1 O15245 1/20 0.41
TMPRSS2 O15393 1/20 0.41
PTP4A3 O75365 1/20 0.41
SLC22A3 O75751 1/20 0.41
F10 P00742 1/20 0.41
PLG P00747 1/20 0.41
S100B P04271 1/20 0.41
CHRM2 P08172 1/20 0.41
CHRM4 P08173 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
SCHEMBL9357925 1.00 ALDH1A1 (0.43) ALDH1A1RECQLKCNA3PRMT1F2
SCHEMBL9358013 1.00 ALDH1A1 (0.43) ALDH1A1RECQLKCNA3PRMT1F2
SCHEMBL21879210 1.00 ALDH1A1 (0.43) ALDH1A1RECQLKCNA3PRMT1F2
SCHEMBL8806298 0.98 ALDH1A1 (0.45) ALDH1A1RECQLKCNA3PRMT1F2
SCHEMBL249623 0.91 ALDH1A1 (0.46) ALDH1A1RECQLKCNA3PRMT1F2
SCHEMBL8809033 0.89 ALDH1A1 (0.42) ALDH1A1RECQLKCNA3PRSS1L3MBTL1
SCHEMBL348921 0.85 ALDH1A1 (0.60) ALDH1A1RECQLKCNA3GAAPRSS1
SCHEMBL19621751 0.84 PRMT1 (0.54) ALDH1A1RECQLKCNA3PRMT1F2
SCHEMBL10731573 0.82 KCNA3 (0.55) ALDH1A1RECQLKCNA3PRMT1F2
SCHEMBL921941 0.81 KCNA3 (0.44) KCNA3PRMT1F2ST14PLAU

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0691327-B1 AMINE DERIVATIVE AND DERMATOLOGIC PREPARATION CONTAINING THE SAME KAO CORP (JP) 1999-07-21 EP disclosed
US-5723497-A AMINE ALCOHOL DERIVATIVES FOR WRINKLE RESISTNCE KAO CORPORATION (JP) 1998-03-03 US disclosed
EP-0691327-A1 AMINE DERIVATIVE AND DERMATOLOGIC PREPARATION CONTAINING THE SAME Kao Corporation (JP) 1996-01-10 EP disclosed