SCHEMBL16016137

SCHEMBL16016137

B=C1CCC(C(C)(C)C)CC1

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.34
RAB9A P51151 1/20 0.34
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
LMNA P02545 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
TP53 P04637 1/20 0.31
HTT P42858 1/20 0.31

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
SCHEMBL5670762 0.74 LMNA (0.37) ALDH1A1RAB9AGAAMAPTSMN1; SMN2
SCHEMBL19595279 0.72 ALDH1A1 (0.34) ALDH1A1RAB9AGAAMAPTSMN1; SMN2
SCHEMBL41691 0.72 ALDH1A1 (0.40) ALDH1A1RAB9AGAAMAPTSMN1; SMN2
SCHEMBL16095310 0.72 ALDH1A1 (0.38) ALDH1A1RAB9AGAAMAPTSMN1; SMN2
SCHEMBL1634068 0.72 ALDH1A1 (0.34) ALDH1A1RAB9AGAAMAPTSMN1; SMN2
SCHEMBL5615220 0.71 EPHX1 (0.42) ALDH1A1RAB9AGAAMAPTSMN1; SMN2
SCHEMBL22797 0.71
SCHEMBL5270433 0.71
SCHEMBL27669745 0.69 ALDH1A1 (0.40) ALDH1A1RAB9AGAAMAPTSMN1; SMN2
SCHEMBL10236415 0.69 ALDH1A1 (0.43) ALDH1A1RAB9AGAAMAPTSMN1; SMN2

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
EP-1809601-B1 COMPOUNDS FOR ALZHEIMER'S DISEASE MANFREDI JOHN (US) 2014-09-10 EP disclosed