SCHEMBL6861378

SCHEMBL6861378

CCCCCCCCOc1ccc(-c2ccc(O)c(F)n2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR5A1 Q13285 1/20 0.53
KDM4E B2RXH2 3/20 0.52
ALDH1A1 P00352 3/20 0.52
HPGD P15428 3/20 0.52
L3MBTL1 Q9Y468 2/20 0.52
HTT P42858 1/20 0.52
RARB P10826 3/20 0.48
CYP2D6 P10635 6/20 0.47
CYP19A1 P11511 5/20 0.47
CYP2C9 P11712 4/20 0.47
CYP2C19 P33261 4/20 0.47
CYP1A2 P05177 3/20 0.47
LTA4H P09960 1/20 0.47
NPC1 O15118 1/20 0.46
MAPT P10636 1/20 0.46
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HRH3 Q9Y5N1 1/20 0.45
TP53 P04637 1/20 0.44
TSHR P16473 1/20 0.44

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
SCHEMBL8506187 0.99 NR5A1 (0.51) NR5A1KDM4EALDH1A1HPGDL3MBTL1
SCHEMBL8505255 0.90 NR5A1 (0.44) NR5A1KDM4EALDH1A1HPGDL3MBTL1
SCHEMBL9138896 0.85 KDM4E (0.53) NR5A1KDM4EALDH1A1HPGDL3MBTL1
SCHEMBL9140257 0.85 KDM4E (0.53) NR5A1KDM4EALDH1A1HPGDL3MBTL1
SCHEMBL6863382 0.85 KDM4E (0.53) NR5A1KDM4EALDH1A1HPGDL3MBTL1
SCHEMBL8506313 0.85 KDM4E (0.53) NR5A1KDM4EALDH1A1HPGDL3MBTL1
SCHEMBL8506175 0.84 KDM4E (0.50) NR5A1KDM4EALDH1A1HPGDL3MBTL1
SCHEMBL8504280 0.84 KDM4E (0.52) NR5A1KDM4EALDH1A1HPGDL3MBTL1
SCHEMBL7110595 0.83 KDM4E (0.51) NR5A1KDM4EALDH1A1HPGDL3MBTL1
SCHEMBL6863866 0.83 KDM4E (0.51) NR5A1KDM4EALDH1A1HPGDL3MBTL1

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-0930301-B1 2-Fluoropyridine, process for producing it and its use in liquid crystal mixtures AVENTIS RES & TECH GMBH & CO (DE) 2004-07-28 EP disclosed
EP-0513262-B1 3,6-DISUBSTITUTED 2-FLUOROPYRIDINES MERCK PATENT GMBH (DE) 2000-04-05 EP disclosed
EP-0563146-B1 2-FLUOROPYRIDINE, PROCESS FOR PRODUCING IT AND ITS USE IN LIQUID CRYSTAL MIXTURES HOECHST AG (DE) 1999-10-06 EP disclosed
EP-0930301-A1 2-Fluoropyridine, process for producing it and its use in liquid crystal mixtures HOECHST AKTIENGESELLSCHAFT (DE) 1999-07-21 EP disclosed
US-5630962-A 2-Fluoropyridines, their preparation and their use in liquid crystal mixtures HOECHST AKTIENGESELLSCHAFT (DE) 1997-05-20 US disclosed
US-5389291-A Components of liquid crystalline media MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1995-02-14 US disclosed
EP-0563146-A1 2-FLUOROPYRIDINE, PROCESS FOR PRODUCING IT AND ITS USE IN LIQUID CRYSTAL MIXTURES HOECHST AKTIENGESELLSCHAFT (DE) 1993-10-06 EP disclosed
EP-0513262-A1 3,6-DISUBSTITUTED 2-HALOPYRIDINES MERCK PATENT GmbH (DE) 1992-11-19 EP disclosed
WO-1992011241-A1 2-FLUOROPYRIDINE, PROCESS FOR PRODUCING IT AND ITS USE IN LIQUID CRYSTAL MIXTURES HOECHST AKTIENGESELLSCHAFT (DE) 1992-07-09 WO disclosed
WO-1992009576-A1 3,6-DISUBSTITUTED 2-HALOPYRIDINES MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1992-06-11 WO disclosed