SCHEMBL9687753

SCHEMBL9687753

CC1CN(c2nc3c(cc2F)c(=O)c(C(=O)O)cn3C2CC2)CCN1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.63
HSD17B10 Q99714 5/20 0.63
ALDH1A1 P00352 4/20 0.63
HPGD P15428 4/20 0.63
KCNH2 Q12809 2/20 0.63
POLB P06746 1/20 0.63
PRKD3 O94806 1/20 0.63
ALOX15 P16050 1/20 0.63
OPRM1 P35372 1/20 0.63
CLK2 P49760 1/20 0.63
CLK4 Q9HAZ1 1/20 0.63
TDP1 Q9NUW8 1/20 0.63
DPP4 P27487 6/20 0.60
CHRM2 P08172 1/20 0.57
DRD1 P21728 1/20 0.57
HRH3 Q9Y5N1 1/20 0.56
LMNA P02545 3/20 0.55
CYP2C9 P11712 2/20 0.55
ATP6V1B2 P21281 1/20 0.55
TBXA2R P21731 1/20 0.55

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
SCHEMBL9687424 0.89 DPP4 (0.66) KDM4EHSD17B10ALDH1A1HPGDKCNH2
SCHEMBL9686854 0.89 KDM4E (0.54) KDM4EHSD17B10ALDH1A1HPGDKCNH2
SCHEMBL9687790 0.88 KDM4E (0.51) KDM4EHSD17B10ALDH1A1HPGDKCNH2
SCHEMBL311935 0.87 LMNA (0.68) KDM4EHSD17B10ALDH1A1HPGDKCNH2
SCHEMBL9686438 0.87 DPP4 (0.68) KDM4EHSD17B10ALDH1A1HPGDKCNH2
SCHEMBL9685613 0.86 DPP4 (0.68) KDM4EHSD17B10ALDH1A1HPGDKCNH2
SCHEMBL9685551 0.85 LMNA (0.55) KDM4EHSD17B10ALDH1A1HPGDKCNH2
SCHEMBL9775909 0.85 KCNH2 (0.56) KDM4EHSD17B10ALDH1A1HPGDKCNH2
SCHEMBL10928412 0.84 DPP4 (0.64) KDM4EHSD17B10ALDH1A1HPGDPOLB
Hydrochloric Acid SCHEMBL10549780 0.84 DPP4 (0.59) KDM4EHSD17B10ALDH1A1HPGDDPP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0187376-B1 6,7-DISUBSTITUTED 1-CYCLOPROPYL-1,4-DIHYDRO-4-OXO-1,8-NAPHTHYRIDINE-3-CARBOXYLIC ACIDS BAYER AG (DE) 1992-05-13 EP claimed
EP-0160578-B1 1,8-NAPHTHYRIDINE DERIVATIVES DAIICHI SEIYAKU CO., LTD. (JP) 1989-11-23 EP claimed
JP-63099070-A None JP disclosed
JP-60172981-A None JP disclosed
EP-0187376-B1 6,7-DISUBSTITUTED 1-CYCLOPROPYL-1,4-DIHYDRO-4-OXO-1,8-NAPHTHYRIDINE-3-CARBOXYLIC ACIDS BAYER AG (DE) 1992-05-13 EP disclosed
EP-0160578-B1 1,8-NAPHTHYRIDINE DERIVATIVES DAIICHI SEIYAKU CO., LTD. (JP) 1989-11-23 EP disclosed
JP-S6399070-A 1,8-NAPHTHYRIDINE DERIVATIVE DAI ICHI SEIYAKU CO LTD 1988-04-30 JP disclosed
EP-0187376-A2 6,7-Disubstituted 1-cyclopropyl-1,4-dihydro-4-oxo-1,8-naphthyridine-3-carboxylic acids BAYER AG (DE) 1986-07-16 EP disclosed
EP-0160578-A1 1,8-Naphthyridine derivatives DAIICHI SEIYAKU CO., LTD. (JP) 1985-11-06 EP disclosed
JP-S60172981-A 1,8-NAPHTHYRIDINE DERIVATIVE DAI ICHI SEIYAKU CO LTD 1985-09-06 JP disclosed