SCHEMBL7741979

SCHEMBL7741979

CCOC(=O)CCCCCn1c(CCl)nc2ccccc21

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FAAH O00519 3/20 0.56
PTGDR2 Q9Y5Y4 4/20 0.56
RECQL P46063 1/20 0.51
TP53 P04637 3/20 0.50
KDM4E B2RXH2 2/20 0.50
HSD17B10 Q99714 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.49
LMNA P02545 1/20 0.49
HPGD P15428 2/20 0.49
HTT P42858 2/20 0.49
ALDH1A1 P00352 1/20 0.49
POLB P06746 1/20 0.49
MAPT P10636 1/20 0.48
GAA P10253 1/20 0.47

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
SCHEMBL7745965 0.90 SMN1; SMN2 (0.58) FAAHPTGDR2RECQLTP53KDM4E
SCHEMBL22965212 0.84 PTGDR2 (0.59) FAAHPTGDR2TP53KDM4EHSD17B10
SCHEMBL22965246 0.84 PTGDR2 (0.54) FAAHPTGDR2RECQLKDM4EHSD17B10
SCHEMBL22965231 0.83 TSHR (0.59) FAAHPTGDR2RECQLKDM4EHSD17B10
SCHEMBL30536652 0.81 KDM4E (0.53) FAAHPTGDR2RECQLKDM4EHSD17B10
SCHEMBL7746512 0.81 PTGDR2 (0.48) FAAHPTGDR2RECQLKDM4EHSD17B10
SCHEMBL16421862 0.81 GAA (0.59) FAAHPTGDR2TP53KDM4EHSD17B10
SCHEMBL3003332 0.81 PTGDR2 (0.55) FAAHPTGDR2TP53KDM4EHSD17B10
SCHEMBL9430801 0.81 PTGDR2 (0.55) FAAHPTGDR2KDM4EHSD17B10SMN1; SMN2
SCHEMBL30184968 0.80 TLR8 (0.65) RECQLTP53SMN1; SMN2LMNAHTT

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-6774134-B2 FOR THERAPY OF RESPIRATORY SYNCYTIAL VIRUS INFECTION BRISTOL-MYERS SQUIBB COMPANY 2004-08-10 US disclosed
US-6774134-B2 FOR THERAPY OF RESPIRATORY SYNCYTIAL VIRUS INFECTION BRISTOL-MYERS SQUIBB COMPANY 2004-08-10 US disclosed