SCHEMBL9775962

SCHEMBL9775962

CC1CN(c2c(F)cc3cc4c(=O)c(C(=O)O)cn(C)c4nc3c2F)CCN1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.60
ALDH1A1 P00352 9/20 0.60
HPGD P15428 8/20 0.60
HSD17B10 Q99714 8/20 0.60
PMP22 Q01453 1/20 0.59
KCNH2 Q12809 3/20 0.51
POLB P06746 3/20 0.51
OPRM1 P35372 2/20 0.51
PRKD3 O94806 1/20 0.51
ALOX15 P16050 1/20 0.51
CLK2 P49760 1/20 0.51
CLK4 Q9HAZ1 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
HRH3 Q9Y5N1 2/20 0.43
LMNA P02545 4/20 0.42
CYP2C9 P11712 2/20 0.42
ATP6V1B2 P21281 1/20 0.42
TBXA2R P21731 1/20 0.42
EDNRA P25101 1/20 0.42
TARBP2 Q15633 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
SCHEMBL9775887 0.89 ALDH1A1 (0.62) KDM4EALDH1A1HPGDHSD17B10PMP22
SCHEMBL9775878 0.88 KDM4E (0.51) KDM4EALDH1A1HPGDHSD17B10PMP22
SCHEMBL9786115 0.88 KDM4E (0.47) KDM4EALDH1A1HPGDHSD17B10PMP22
SCHEMBL9786109 0.88 KDM4E (0.47) KDM4EALDH1A1HPGDHSD17B10PMP22
SCHEMBL9786133 0.88 KDM4E (0.47) KDM4EALDH1A1HPGDHSD17B10PMP22
SCHEMBL9775884 0.88 LMNA (0.52) KDM4EALDH1A1HPGDHSD17B10PMP22
SCHEMBL9786246 0.88 KDM4E (0.46) KDM4EALDH1A1HPGDHSD17B10PMP22
SCHEMBL9367740 0.85 KDM4E (0.44) KDM4EALDH1A1HPGDHSD17B10PMP22
SCHEMBL9786171 0.85 KDM4E (0.44) KDM4EALDH1A1HPGDHSD17B10PMP22
SCHEMBL9786184 0.85 KDM4E (0.44) KDM4EALDH1A1HPGDHSD17B10PMP22

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5004745-A Benzo[1,8]naphthyridine derivatives, their preparation and the compositions which contain them LABORATOIRE ROGER BELLON (FR) 1991-04-02 US disclosed
US-4970213-A Benzo(1,8)naphthyridine derivatives as intermediates RHONE-POULENC SANTE (FR) 1990-11-13 US disclosed