SCHEMBL9687559

SCHEMBL9687559

NC(=O)c1cc(F)c(O)nc1O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DGAT1 O75907 1/20 0.42
▸ ROCK2 O75116 2/20 0.40
▸ KEAP1 Q14145 1/20 0.38
▸ NFE2L2 Q16236 1/20 0.38
▸ PARP1 P09874 2/20 0.37
▸ MAPT P10636 2/20 0.36
▸ HTT P42858 1/20 0.36
▸ KDM4E B2RXH2 2/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ HPGD P15428 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ ROCK1 Q13464 1/20 0.35
▸ IKBKB O14920 1/20 0.35
▸ CASP1 P29466 1/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ CD38 P28907 1/20 0.35
▸ LMNA P02545 1/20 0.34
▸ CHUK O15111 1/20 0.34

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
SCHEMBL8751834 0.80 KEAP1 (0.53) KEAP1NFE2L2MAPTKDM4EALDH1A1
SCHEMBL9805668 0.78 SMN1; SMN2 (0.45) KEAP1NFE2L2MAPTHTTKDM4E
SCHEMBL565790 0.77 NQO2 (0.40) PARP1MAPTHTTKDM4EALDH1A1
SCHEMBL10186882 0.77 NNMT (0.44) PARP1KDM4EIKBKBCD38LMNA
SCHEMBL565674 0.77 LMNA (0.42) MAPTHTTKDM4EALDH1A1HPGD
SCHEMBL811340 0.76 DGAT1 (0.58) DGAT1ROCK2KEAP1NFE2L2PARP1
SCHEMBL30733977 0.74 DGAT1 (0.42) DGAT1PARP1MAPTKDM4EALDH1A1
SCHEMBL8751819 0.74 CA12 (0.43) KDM4EALDH1A1HPGDTSHRNPC1
SCHEMBL2323641 0.72 DGAT1 (0.54) DGAT1ROCK2PARP1MAPTKDM4E
SCHEMBL16182121 0.71 DGAT1 (0.48) DGAT1ROCK2PARP1MAPTKDM4E

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
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
EP-0333020-A2 Process for the preparation of substituted pyridines ABBOTT LABORATORIES (US) 1989-09-20 — — EP disclosed
US-4840954-A BACTERICIDE BAYER AKTIENGESELLSCHAFT (DE) 1989-06-20 — — US 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
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