SCHEMBL7211528

SCHEMBL7211528

CCCCCCCc1ccc(C(=O)OC)s1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.57
NPSR1 Q6W5P4 2/20 0.51
TSHR P16473 1/20 0.51
MAPK1 P28482 1/20 0.51
ATM Q13315 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
POLB P06746 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
LMNA P02545 2/20 0.50
ALDH1A1 P00352 2/20 0.50
PRNP P04156 1/20 0.50
RECQL P46063 1/20 0.50
RXFP1 Q9HBX9 1/20 0.50
PPARG P37231 1/20 0.45
NCOA2 Q15596 1/20 0.45
NCOA1 Q15788 1/20 0.45
NCOA3 Q9Y6Q9 1/20 0.45
MRGPRX4 Q96LA9 1/20 0.45
FAAH O00519 1/20 0.41
PARP1 P09874 1/20 0.41

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
SCHEMBL27621806 0.98 HPGD (0.55) HPGDNPSR1TSHRMAPK1ATM
SCHEMBL7211399 0.94 HPGD (0.54) HPGDNPSR1TSHRMAPK1ATM
SCHEMBL19035453 0.88 HPGD (0.50) HPGDNPSR1TSHRMAPK1ATM
SCHEMBL6981207 0.88 HPGD (0.57) HPGDNPSR1TSHRMAPK1ATM
SCHEMBL5887893 0.87 HPGD (0.53) HPGDNPSR1TSHRMAPK1ATM
SCHEMBL6978193 0.86 HPGD (0.59) HPGDNPSR1TSHRMAPK1ATM
SCHEMBL2162982 0.86 HPGD (0.55) HPGDNPSR1TSHRMAPK1ATM
SCHEMBL8971725 0.85 POLB (0.59) HPGDPOLBTDP1LMNAALDH1A1
SCHEMBL8971941 0.85 POLB (0.59) HPGDPOLBTDP1LMNAALDH1A1
SCHEMBL6653369 0.85 POLB (0.59) HPGDPOLBTDP1LMNAALDH1A1

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-6616989-B1 A switching and/or display device CLARIANT INTERNATIONAL LTD. (CH) 2003-09-09 US disclosed