SCHEMBL7557779

SCHEMBL7557779

CCCCCNC(=O)CCCCCCCOc1cc[c]cc1

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 11/20 0.57
CNR1 P21554 11/20 0.57
FAAH O00519 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.51
ALDH1A1 P00352 1/20 0.51
CASP2 P42575 1/20 0.50
MEN1 O00255 1/20 0.50
HPGD P15428 1/20 0.50
KMT2A Q03164 1/20 0.50

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
SCHEMBL7552633 0.95 SMN1; SMN2 (0.56) CNR2CNR1FAAHSMN1; SMN2ALDH1A1
SCHEMBL7749263 0.85 CNR2 (0.65) CNR2CNR1ALDH1A1
SCHEMBL7197986 0.85 CNR2 (0.65) CNR2CNR1ALDH1A1
SCHEMBL7193578 0.85 CNR2 (0.65) CNR2CNR1ALDH1A1
SCHEMBL7750909 0.82 CNR2 (0.61) CNR2CNR1SMN1; SMN2ALDH1A1
SCHEMBL7747947 0.82 CNR2 (0.61) CNR2CNR1SMN1; SMN2ALDH1A1
SCHEMBL7192804 0.82 LTA4H (0.65) CNR2CNR1ALDH1A1
SCHEMBL7197981 0.82 LTA4H (0.65) CNR2CNR1ALDH1A1
SCHEMBL7197833 0.82 LTA4H (0.65) CNR2CNR1ALDH1A1
SCHEMBL15904029 0.80 RECQL (0.72) SMN1; SMN2ALDH1A1MEN1HPGDKMT2A

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-1219631-A1 ANTIANDROGEN AGENTS CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2002-07-03 EP disclosed