SCHEMBL8941946

SCHEMBL8941946

CCOC(=O)c1cn(CC)c2nc3cc(F)c(F)cc3cc2c1=O

nearest known ligand 0.63

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.55
TSHR P16473 3/20 0.55
KMT2A Q03164 4/20 0.52
MAPK1 P28482 3/20 0.52
SMN1; SMN2 Q16637 4/20 0.50
MAPT P10636 3/20 0.50
THRB P10828 1/20 0.50
LMNA P02545 3/20 0.49
KDM4E B2RXH2 3/20 0.48
HPGD P15428 3/20 0.48
MEN1 O00255 3/20 0.48
HSD17B10 Q99714 2/20 0.48
NPC1 O15118 1/20 0.48
HTT P42858 1/20 0.48
RAB9A P51151 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
RXFP1 Q9HBX9 1/20 0.48
POLB P06746 1/20 0.46

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
SCHEMBL9775959 0.92 ALDH1A1 (0.52) ALDH1A1TSHRKMT2AMAPK1SMN1; SMN2
SCHEMBL9786163 0.91 KMT2A (0.50) ALDH1A1TSHRKMT2AMAPK1SMN1; SMN2
SCHEMBL7234823 0.88 KMT2A (0.47) ALDH1A1TSHRKMT2AMAPK1MAPT
SCHEMBL8942028 0.86 LMNA (0.59) ALDH1A1TSHRKMT2AMAPK1LMNA
SCHEMBL8942074 0.86 KMT2A (0.46) ALDH1A1TSHRKMT2AMAPK1MAPT
SCHEMBL9775932 0.86 ALDH1A1 (0.54) ALDH1A1TSHRKMT2AMAPK1SMN1; SMN2
SCHEMBL8942039 0.86 ALDH1A1 (0.51) ALDH1A1TSHRKMT2AMAPK1SMN1; SMN2
SCHEMBL8941932 0.85 KMT2A (0.45) ALDH1A1TSHRKMT2AMAPK1SMN1; SMN2
SCHEMBL9775880 0.83 KMT2A (0.45) ALDH1A1TSHRKMT2AMAPK1SMN1; SMN2
SCHEMBL8942125 0.83 ALDH1A1 (0.51) ALDH1A1TSHRKMT2AMAPK1SMN1; SMN2

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 6 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 disclosed
US-5484921-A Process for preparing benzo[b]naphthyridines LABORATOIRE ROGER BELLON (FR) 1996-01-16 US disclosed
US-5442070-A Derivatives of fluoro-quinoline carboxylic-3-acid and preparation therefor LABORATOIRE ROGER BELLON (FR) 1995-08-15 US disclosed
US-5053509-A Microbiocides; AIDS LABORATOIRE ROGER BELLON (FR) 1991-10-01 US disclosed
US-4990515-A Chemical intermediates RHONE-POULENC SANTE (FR) 1991-02-05 US disclosed
US-4970213-A Benzo(1,8)naphthyridine derivatives as intermediates RHONE-POULENC SANTE (FR) 1990-11-13 US disclosed