SCHEMBL10696412

SCHEMBL10696412

CCCC[C]1CCCCO1

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.34
CA9 Q16790 1/20 0.34
LMNA P02545 1/20 0.32
MAPK1 P28482 1/20 0.32
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HTT P42858 1/20 0.30
ATM Q13315 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
SCHEMBL10699085 0.94 MEN1 (0.37) CA1CA9LMNAMEN1KMT2A
SCHEMBL12615012 0.93
SCHEMBL27840603 0.90 CCR5 (0.36) CA1CA9LMNAMEN1KMT2A
SCHEMBL10696277 0.87 MEN1 (0.34) MEN1KMT2A
SCHEMBL10698398 0.86
SCHEMBL1383985 0.86
SCHEMBL16597953 0.79
SCHEMBL2868810 0.77 TSHR (0.38) LMNAKDM4EALDH1A1
SCHEMBL5597049 0.77 TSHR (0.38) LMNAKDM4EALDH1A1
SCHEMBL449800 0.77 TSHR (0.38) LMNAKDM4EALDH1A1

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
EP-0253767-A1 Parasiticide and insecticide CIBA-GEIGY AG (CH) 1988-01-20 EP claimed
EP-0253767-A1 Parasiticide and insecticide CIBA-GEIGY AG (CH) 1988-01-20 EP disclosed