SCHEMBL30501032

SCHEMBL30501032

Cc1ccc(-c2cc(C(N)=O)c(C)n2Cc2ccc3c(c2)OCO3)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.55
TSHR P16473 4/20 0.55
LMNA P02545 4/20 0.55
MAPT P10636 4/20 0.50
HTT P42858 4/20 0.48
HSD17B10 Q99714 2/20 0.47
KDM4E B2RXH2 1/20 0.47
MEN1 O00255 1/20 0.47
CASP1 P29466 1/20 0.47
KMT2A Q03164 1/20 0.47
TP53 P04637 1/20 0.47
EDNRB P24530 1/20 0.46
EDNRA P25101 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
ALDH1A1 P00352 1/20 0.45
POLB P06746 1/20 0.45
CMA1 P23946 1/20 0.45
HPGD P15428 1/20 0.45
FAAH O00519 1/20 0.45
GAA P10253 1/20 0.45

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
SCHEMBL20386120 1.00 SMN1; SMN2 (0.55) SMN1; SMN2TSHRLMNAMAPTHTT
SCHEMBL20379154 0.92 LMNA (0.53) SMN1; SMN2TSHRLMNAMAPTHTT
SCHEMBL20379069 0.92 LMNA (0.53) SMN1; SMN2TSHRLMNAMAPTHTT
SCHEMBL30501034 0.91 TSHR (0.55) SMN1; SMN2TSHRLMNAMAPTHTT
SCHEMBL20386134 0.91 TSHR (0.55) SMN1; SMN2TSHRLMNAMAPTHTT
SCHEMBL21565630 0.80 SMN1; SMN2 (0.50) SMN1; SMN2TSHRLMNAMAPTHTT
SCHEMBL2883552 0.79 LMNA (0.53) SMN1; SMN2TSHRLMNAMAPTHTT
SCHEMBL28878859 0.77 SMN1; SMN2 (0.57) SMN1; SMN2TSHRLMNAMAPTHTT
SCHEMBL20379417 0.74 SMN1; SMN2 (0.54) SMN1; SMN2TSHRLMNAMAPTHTT
SCHEMBL21387721 0.72 THRB (0.48) SMN1; SMN2TSHRLMNAMAPTHTT

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
CN-116462666-A Cytoprotective compounds and uses thereof 瑞士苏黎世联邦理工学院 2023-07-21 CN claimed
CN-116462666-A Cytoprotective compounds and uses thereof 瑞士苏黎世联邦理工学院 2023-07-21 CN disclosed