SCHEMBL10425643

SCHEMBL10425643

COC(=O)c1ccc(C=C2CCCC(=Cc3ccc(C(=O)OC)cc3)C2=O)cc1

nearest known ligand 0.67

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.67
HPGD P15428 1/20 0.67
HTT P42858 1/20 0.67
CYP1A2 P05177 3/20 0.62
F2 P00734 10/20 0.60
F10 P00742 10/20 0.59
HSD11B1 P28845 2/20 0.58
CYP2C9 P11712 1/20 0.58
F3 P13726 1/20 0.58
PLAU P00749 1/20 0.55
HPN P05981 1/20 0.55
EGFR P00533 2/20 0.55
PIM1 P11309 1/20 0.55

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
SCHEMBL30106702 0.80 MAPT (1.00) MAPTHPGDHTTCYP1A2F2
SCHEMBL8548291 0.79 MAPT (0.66) MAPTHPGDHTT
SCHEMBL8548289 0.79 MAPT (0.66) MAPTHPGDHTT
SCHEMBL4662026 0.78 ALDH1A1 (0.61) MAPTPIM1
SCHEMBL3598032 0.78 DYRK1A (0.65) MAPTPIM1
SCHEMBL3598035 0.78 DYRK1A (0.65) MAPTPIM1
SCHEMBL10426637 0.77 ALDH1A1 (0.51) MAPTHPGDPIM1
SCHEMBL17693074 0.77 CYP1A2 (1.00) MAPTCYP1A2HSD11B1CYP2C9F3
SCHEMBL22105147 0.76 MIF (0.72)
SCHEMBL5089939 0.76 CYP19A1 (0.54) MAPTCYP1A2EGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4965399-A 1,5-diaryl-3-pentanol compounds and processes for the preparation thereof EASTMAN KODAK COMPANY (US) 1990-10-23 US disclosed