SCHEMBL15087786

SCHEMBL15087786

CCCCCOc1cc(C=O)ccc1C=O

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ FDPS P14324 1/20 0.53
▸ ALDH1A1 P00352 12/20 0.47
▸ HPGD P15428 7/20 0.44
▸ SMN1; SMN2 Q16637 6/20 0.44
▸ HTT P42858 3/20 0.44
▸ MAPT P10636 8/20 0.44
▸ LMNA P02545 4/20 0.43
▸ NPSR1 Q6W5P4 3/20 0.43
▸ TSHR P16473 1/20 0.43
▸ TDP1 Q9NUW8 2/20 0.43
▸ L3MBTL1 Q9Y468 2/20 0.43
▸ CYP2C9 P11712 2/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ CYP1A2 P05177 1/20 0.41
▸ HSP90AA1 P07900 1/20 0.41
▸ CYP2C19 P33261 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
SCHEMBL18886645 0.98 FDPS (0.51) FDPSALDH1A1HPGDSMN1; SMN2HTT
SCHEMBL28271354 0.98 FDPS (0.51) FDPSALDH1A1HPGDSMN1; SMN2HTT
SCHEMBL27821639 0.98 FDPS (0.51) FDPSALDH1A1HPGDSMN1; SMN2HTT
SCHEMBL29184154 0.98 FDPS (0.51) FDPSALDH1A1HPGDSMN1; SMN2HTT
SCHEMBL26908625 0.95 FDPS (0.54) FDPSALDH1A1HPGDSMN1; SMN2HTT
SCHEMBL28965219 0.90 FDPS (0.56) FDPSALDH1A1HPGDSMN1; SMN2HTT
SCHEMBL22160252 0.90 FDPS (0.54) FDPSALDH1A1HPGDSMN1; SMN2HTT
SCHEMBL22160238 0.88 FDPS (0.56) FDPSALDH1A1HPGDSMN1; SMN2HTT
SCHEMBL6194744 0.87 FDPS (0.65) FDPSALDH1A1HPGDSMN1; SMN2HTT
SCHEMBL30317609 0.87 FDPS (0.65) FDPSALDH1A1HPGDSMN1; SMN2HTT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2797946-B1 SIALIC ACID DIMERS BROSSMER REINHARD (DE) 2016-05-04 — — EP disclosed
WO-2013097942-A1 SIALIC ACID DIMERS BROSSMER REINHARD (DE) 2013-07-04 — — WO disclosed
EP-2610263-A1 Sialic acid dimers Brossmer, Reinhard (DE) 2013-07-03 — — EP disclosed
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