SCHEMBL9012245

SCHEMBL9012245

O=C(CCC1CCCCC1)OC1CCCCC1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 2/20 0.56
CYP2C19 P33261 1/20 0.49
HPGD P15428 1/20 0.47
HTT P42858 1/20 0.46
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
MAPT P10636 1/20 0.44
ATM Q13315 1/20 0.44
CYP19A1 P11511 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MIF P14174 1/20 0.43
EPHX1 P07099 2/20 0.43
KLK7 P49862 2/20 0.42
LMNA P02545 1/20 0.42

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
SCHEMBL25252093 1.00 NAAA (0.56) NAAACYP2C19HPGDHTTMEN1
SCHEMBL9011955 0.98 NAAA (0.55) NAAACYP2C19HPGDHTTMEN1
SCHEMBL19007855 0.89 NAAA (0.62) NAAACYP2C19HPGDHTTCYP19A1
SCHEMBL30471400 0.87 NAAA (0.45) NAAACYP2C19HPGDHTTMEN1
SCHEMBL9491685 0.85 NAAA (0.68) NAAACYP2C19HPGDHTTMEN1
SCHEMBL28779449 0.85 NAAA (0.44) NAAACYP2C19HPGDHTTMAPT
SCHEMBL7568980 0.85 NAAA (0.66) NAAACYP2C19HPGDHTTCYP19A1
SCHEMBL31069913 0.85 NAAA (0.66) NAAACYP2C19HPGDHTTCYP19A1
SCHEMBL258780 0.85 NAAA (0.66) NAAACYP2C19HPGDHTTCYP19A1
SCHEMBL9004410 0.83 HPGD (0.50) HPGDMEN1KMT2AMAPTATM

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
US-5525506-A Process for production of avermectins and cultures therefor PFIZER INC. (US) 1996-06-11 US disclosed
US-5238848-A Cultures for production of avermectins PFIZER INC (US) 1993-08-24 US disclosed
US-5077278-A Parasiticides PFIZER INC. (US) 1991-12-31 US disclosed