SCHEMBL7751997

SCHEMBL7751997

[CH2]Cc1ccc(OC(C)OC)cc1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.39
SLC6A4 P31645 1/20 0.38
ALDH1A1 P00352 2/20 0.37
LMNA P02545 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.35
TP53 P04637 1/20 0.35
CYP3A4 P08684 1/20 0.35
ALOX15 P16050 1/20 0.35
TSHR P16473 1/20 0.35
ALOX12 P18054 1/20 0.35
CYP1A2 P05177 2/20 0.35
CYP2D6 P10635 2/20 0.35
CYP2C19 P33261 2/20 0.35
GAA P10253 1/20 0.35
IDO1 P14902 1/20 0.34
FFAR1 O14842 1/20 0.33
HTT P42858 1/20 0.33
SIGMAR1 Q99720 1/20 0.32
LDHA P00338 1/20 0.32

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
SCHEMBL6418869 0.83 POLB (0.55) POLBALDH1A1LMNACYP1A2CYP2D6
SCHEMBL22042809 0.83 LTA4H (0.48) POLBSLC6A4ALDH1A1LMNA
SCHEMBL13156094 0.81 PPARG (0.45) POLBSLC6A4ALDH1A1LMNASMN1; SMN2
SCHEMBL9809283 0.79 MAOB (0.47) SLC6A4
SCHEMBL2982874 0.79 POLB (0.39) POLBSLC6A4ALDH1A1LMNASMN1; SMN2
SCHEMBL8719660 0.78 PPARG (0.45) POLBALDH1A1SMN1; SMN2FFAR1HTT
SCHEMBL15112930 0.76 POLB (0.37) POLBSLC6A4ALDH1A1LMNASMN1; SMN2
SCHEMBL130044 0.75 IDO1 (0.58) SLC6A4ALDH1A1SMN1; SMN2TP53CYP3A4
SCHEMBL19755152 0.75 POLB (0.40) POLBSLC6A4ALDH1A1LMNACYP1A2
SCHEMBL13790477 0.75 POLB (0.36) POLBSLC6A4ALDH1A1LMNASMN1; SMN2

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-6255120-B1 HYDROXYAMIDES ATTACHED TO SOLID SUPPORT PHARMACOPEIA, INC. 2001-07-03 US claimed