SCHEMBL11345558

SCHEMBL11345558

C=CCCCCC(CCC12CCCC(CC1)N2Cc1ccccc1)C(=O)OCC

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.39
POLB P06746 1/20 0.39
PKM P14618 1/20 0.39
MAPT P10636 1/20 0.39
KDM4E B2RXH2 2/20 0.36
FAAH O00519 3/20 0.35
MGLL Q99685 2/20 0.35
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
NPY1R P25929 1/20 0.34
ACE P12821 2/20 0.34
ALDH1A1 P00352 2/20 0.34
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
SIGMAR1 Q99720 1/20 0.33

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
SCHEMBL8947196 0.74 KDM4E (0.45) LMNAPOLBPKMMAPTKDM4E
SCHEMBL3123708 0.65 CPB2 (0.44) LMNAMAPTFAAHALDH1A1SMN1; SMN2
SCHEMBL28673893 0.65 CA1 (0.50) LMNAFAAHMGLLKMT2AALDH1A1
SCHEMBL23833841 0.64 TSHR (0.52) LMNAMAPTFAAHALDH1A1SMN1; SMN2
SCHEMBL3122846 0.64 CPB2 (0.46) LMNAMAPTFAAHALDH1A1SMN1; SMN2
SCHEMBL28532812 0.64 CPB2 (0.45) LMNAMAPTALDH1A1SMN1; SMN2
SCHEMBL6778466 0.63 MEN1 (0.53) LMNAMAPTKMT2AMEN1SMN1; SMN2
SCHEMBL3124113 0.63 CPB2 (0.47) LMNAMAPTALDH1A1SMN1; SMN2
SCHEMBL3125182 0.63 CPB2 (0.47) LMNAMAPTALDH1A1SMN1; SMN2
SCHEMBL8946980 0.62 HTR2C (0.43) LMNAPOLBPKMMAPTKDM4E

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-0031219-A1 Aniline derivatives BEECHAM GROUP PLC (GB) 1981-07-01 EP disclosed