SCHEMBL8079036

SCHEMBL8079036

O=C1CO[C@H](c2ccccc2)O1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
CYP2C19 P33261 2/20 0.45
LMNA P02545 1/20 0.42
POLB P06746 1/20 0.42
TSHR P16473 1/20 0.41
KCNA4 P22459 1/20 0.39
KCNA1 Q09470 1/20 0.39
KCNAB1 Q14722 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP19A1 P11511 2/20 0.38
KDM4E B2RXH2 1/20 0.38
ADORA3 P0DMS8 1/20 0.38
AR P10275 1/20 0.38
MAOB P27338 1/20 0.38
HSD17B10 Q99714 1/20 0.38
SIRT1 Q96EB6 2/20 0.38
ABL1 P00519 1/20 0.38
RIN1 Q13671 1/20 0.38
CA2 P00918 1/20 0.37

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
SCHEMBL8079031 1.00 MEN1 (0.45) MEN1KMT2ACYP2C19LMNAPOLB
SCHEMBL8079034 1.00 MEN1 (0.45) MEN1KMT2ACYP2C19LMNAPOLB
SCHEMBL2533981 0.80 MAOB (0.38) MEN1KMT2ALMNACYP19A1MAOB
SCHEMBL14612067 0.79 CYP2C19 (0.46) MEN1KMT2ACYP2C19TSHRCYP2C9
SCHEMBL14578019 0.79 CYP2C19 (0.46) MEN1KMT2ACYP2C19TSHRCYP2C9
SCHEMBL14612066 0.79 CYP2C19 (0.46) MEN1KMT2ACYP2C19TSHRCYP2C9
SCHEMBL5406897 0.79 CYP2C19 (0.46) MEN1KMT2ACYP2C19TSHRCYP2C9
SCHEMBL5432121 0.79 MEN1 (0.41) MEN1KMT2ACYP2C19LMNAPOLB
SCHEMBL120709 0.78 MEN1 (0.48) MEN1KMT2ACYP2C19LMNAPOLB
SCHEMBL6132937 0.78 MEN1 (0.54) MEN1KMT2ACYP2C19LMNAPOLB

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-6166074-A Pharmaceutical compositions NORSK HYDRO A.S. (NO) 2000-12-26 US claimed
US-6166074-A Pharmaceutical compositions NORSK HYDRO A.S. (NO) 2000-12-26 US disclosed