SCHEMBL8429008

SCHEMBL8429008

O=C(c1ccc(F)cc1)c1ccc(Sc2ccc(C(=O)c3ccc(F)cc3)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.57
CES2 O00748 1/20 0.52
CES1 P23141 1/20 0.52
HPGD P15428 4/20 0.52
LMNA P02545 3/20 0.52
L3MBTL1 Q9Y468 2/20 0.52
MEN1 O00255 1/20 0.49
CYP1A2 P05177 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
KMT2A Q03164 1/20 0.49
ALDH1A1 P00352 5/20 0.48
NPC1 O15118 4/20 0.48
RAB9A P51151 3/20 0.48
KDM4E B2RXH2 2/20 0.48
MAPT P10636 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
TP53 P04637 2/20 0.48
ALPG P10696 1/20 0.48
TSHR P16473 1/20 0.48

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
SCHEMBL7935384 0.92 HPGD (0.54) LTA4HCES2CES1HPGDLMNA
SCHEMBL14647716 0.92 HPGD (0.54) LTA4HCES2CES1HPGDLMNA
SCHEMBL14407951 0.89 SRD5A2 (0.49) LTA4HCES2CES1HPGDLMNA
SCHEMBL1787786 0.89 LTA4H (0.47) LTA4HCES2CES1HPGDLMNA
SCHEMBL1736339 0.85 LTA4H (0.73) LTA4HCES2CES1HPGDLMNA
SCHEMBL8572071 0.85 LTA4H (0.73) LTA4HCES2CES1HPGDLMNA
SCHEMBL238259 0.85 LTA4H (0.73) LTA4HCES2CES1HPGDLMNA
SCHEMBL10992632 0.84 HPGD (0.50) LTA4HCES2CES1HPGDLMNA
SCHEMBL29206742 0.84 ABCC9 (0.46) LTA4HCES2CES1HPGDLMNA
SCHEMBL1127927 0.83 ALDH1A1 (0.49) LTA4HHPGDLMNAL3MBTL1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5869599-A PRODUCING POLYARYLENE SULFIDE FREE OF INORGANIC CONTAMINANATS HAY ALLAN S (CA) 1999-02-09 US disclosed
US-5239042-A Dibenzofuran polymer ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1993-08-24 US disclosed
US-4924014-A Process for the preparation of halogen-containing aromatic compounds HOECHST AKTIENGESELLSCHAFT (DE) 1990-05-08 US disclosed