SCHEMBL7771108

SCHEMBL7771108

NC(=O)CNC(=O)C(F)F

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 1/20 0.35
ALDH1A1 P00352 2/20 0.35
LMNA P02545 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
KDM4E B2RXH2 1/20 0.35
GMNN O75496 1/20 0.35
USP2 O75604 1/20 0.35
TP53 P04637 1/20 0.35
CYP1A2 P05177 1/20 0.35
GLA P06280 1/20 0.35
POLB P06746 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
HPGD P15428 1/20 0.35
ALOX15 P16050 1/20 0.35
CYP2C19 P33261 1/20 0.35
THPO P40225 1/20 0.35
RECQL P46063 1/20 0.35
BLM P54132 1/20 0.35
PMP22 Q01453 1/20 0.35

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
SCHEMBL29231291 0.77 ALDH1A1 (0.54) ALDH1A1LMNATDP1HPGDBLM
SCHEMBL7773733 0.76 ECE1 (0.42) ALDH1A1LMNATDP1KDM4EGMNN
SCHEMBL3088751 0.75 ALDH1A1 (0.41) METAP1ALDH1A1LMNATDP1USP2
SCHEMBL7765744 0.75 ALDH1A1 (0.50) METAP1ALDH1A1LMNATDP1MAPT
SCHEMBL7771102 0.75 ALDH1A1 (0.32) ALDH1A1LMNATDP1MAPTPTGS2
SCHEMBL15808516 0.73 MEN1 (0.47) METAP1ALDH1A1LMNATDP1TP53
SCHEMBL9214801 0.73 TERT (0.42) METAP1ALDH1A1LMNATDP1MAPT
SCHEMBL15623649 0.73 TERT (0.42) METAP1ALDH1A1LMNATDP1MAPT
SCHEMBL24916016 0.72 NOS2 (0.32) METAP1
SCHEMBL2189880 0.71 CA12 (0.35) METAP1ALDH1A1LMNATDP1ALOX15

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
EP-0765879-B1 13-Substituted milbemycin 5-oxime derivatives, their preparation and their use against insects and other pests SANKYO CO (JP) 2001-02-14 EP disclosed
US-5861429-A MITICIDES AND ANTHELMINTICS SANKYO COMPANY, LIMITED (JP) 1999-01-19 US disclosed
EP-0765879-A1 13-Substituted milbemycin 5-oxime derivatives, their preparation and their use against insects and other pests SANKYO COMPANY LIMITED (JP) 1997-04-02 EP disclosed