SCHEMBL8941969

SCHEMBL8941969

CC1(N)CN(c2cc3nc4c(cc3cc2F)c(=O)c(C(=O)O)cn4C2CC2)C1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 6/20 0.48
KDM4E B2RXH2 4/20 0.47
ALDH1A1 P00352 3/20 0.47
LMNA P02545 3/20 0.47
HSD17B10 Q99714 3/20 0.47
HPGD P15428 2/20 0.47
MAPT P10636 1/20 0.47
TOP2A P11388 4/20 0.46
TOP2B Q02880 4/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2C9 P11712 1/20 0.46
CHRM2 P08172 1/20 0.46
DRD1 P21728 1/20 0.46
ABCC4 O15439 1/20 0.43
KCNH2 Q12809 2/20 0.43
PIK3CG P48736 2/20 0.41

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
SCHEMBL8941911 0.91 KDM4E (0.47) DPP4KDM4EALDH1A1LMNAHSD17B10
SCHEMBL8942264 0.90 KDM4E (0.49) DPP4KDM4EALDH1A1LMNAHSD17B10
SCHEMBL8942172 0.89 KDM4E (0.46) DPP4KDM4EALDH1A1LMNAHSD17B10
SCHEMBL8941957 0.88 DPP4 (0.51) DPP4KDM4EALDH1A1LMNAHSD17B10
SCHEMBL8941958 0.87 ALDH1A1 (0.39) DPP4KDM4EALDH1A1LMNAHSD17B10
SCHEMBL8941941 0.87 KDM4E (0.49) DPP4KDM4EALDH1A1LMNAHSD17B10
SCHEMBL8942340 0.86 DPP4 (0.54) DPP4KDM4EALDH1A1LMNAHSD17B10
SCHEMBL9775862 0.85 ALDH1A1 (0.55) DPP4KDM4EALDH1A1LMNAHSD17B10
SCHEMBL8941960 0.84 DPP4 (0.49) DPP4KDM4EALDH1A1LMNAHSD17B10
SCHEMBL8942107 0.84 LMNA (0.52) KDM4EALDH1A1LMNAHSD17B10HPGD

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-5556861-A 1,8 benzonaphthyridine derivatives and antimicrobial compositions LABORATOIRE ROGER BELLON (FR) 1996-09-17 US claimed
US-5556861-A 1,8 benzonaphthyridine derivatives and antimicrobial compositions LABORATOIRE ROGER BELLON (FR) 1996-09-17 US disclosed