SCHEMBL28465786

SCHEMBL28465786

C=Cc1ccccc1C(O)(C=O)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 3/20 0.35
TSHR P16473 2/20 0.35
TRIM24 O15164 1/20 0.34
TRIM33 Q9UPN9 1/20 0.34
CYP2C9 P11712 1/20 0.34
HTT P42858 1/20 0.33
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
THRB P10828 1/20 0.31
BLM P54132 1/20 0.31
KMT2A Q03164 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
NFKB1 P19838 2/20 0.31
CDK4 P11802 1/20 0.31
CCND1 P24385 1/20 0.31
TGM2 P21980 1/20 0.31
PDPK1 O15530 1/20 0.31
KCNN4 O15554 3/20 0.30
KCNE1 P15382 1/20 0.30

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
SCHEMBL7043480 0.80 ALDH1A1 (0.42) KDM4EALDH1A1TSHRTRIM24TRIM33
SCHEMBL863162 0.77 KDM4E (0.44) KDM4EALDH1A1TSHRCYP2C9KMT2A
SCHEMBL25432239 0.76 ERN1 (0.40) KDM4EALDH1A1TSHRTRIM24TRIM33
SCHEMBL811207 0.75 KCNN4 (0.50) KDM4ECYP2C9KCNN4KCNE1KCNQ1
SCHEMBL10047426 0.75 MAPT (0.36) KDM4EALDH1A1CYP2C9HTTKMT2A
SCHEMBL1628202 0.75 ALDH1A1 (0.41) ALDH1A1TSHRCYP2C9LMNANFKB1
SCHEMBL7524435 0.74 ALDH1A1 (0.41) KDM4EALDH1A1TSHRHTTKCNN4
SCHEMBL26919784 0.71 KDM4E (0.42) KDM4EALDH1A1TSHRCYP2C9HTT
SCHEMBL4789180 0.71 ALDH1A1 (0.41) KDM4EALDH1A1TSHRKMT2ATDP1
SCHEMBL146715 0.71 ALDH1A1 (0.43) KDM4EALDH1A1TSHRHTTKCNN4

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
CN-111868578-A Light control body and light control window glass 积水化学工业株式会社 2020-10-30 CN disclosed