SCHEMBL6160843

SCHEMBL6160843

COc1ccc(Cc2ccccc2N)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.60
ALDH1A1 P00352 3/20 0.49
CYP2D6 P10635 1/20 0.49
ATM Q13315 1/20 0.49
MAOB P27338 1/20 0.47
LMNA P02545 1/20 0.46
HPGD P15428 1/20 0.46
IDO1 P14902 2/20 0.46
AGXT P21549 2/20 0.46
TAAR1 Q96RJ0 1/20 0.46
POLB P06746 1/20 0.45
RAB9A P51151 2/20 0.45
TDP1 Q9NUW8 2/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
KDM4E B2RXH2 1/20 0.45
GAA P10253 1/20 0.45
MAPT P10636 1/20 0.45
THRB P10828 1/20 0.45
HTT P42858 1/20 0.45

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
SCHEMBL28118711 0.86 LTA4H (0.53) LTA4HALDH1A1CYP2D6ATMMAOB
SCHEMBL28251912 0.86 LTA4H (0.72) LTA4HMAOBIDO1RAB9ATDP1
SCHEMBL2027109 0.84 LTA4H (0.69) LTA4HMAOBIDO1RAB9ATDP1
SCHEMBL6226356 0.84 ABCB1 (0.56) LTA4HMAOBTAAR1
SCHEMBL3902050 0.81 LTA4H (0.60) LTA4HALDH1A1CYP2D6ATMMAOB
SCHEMBL30837375 0.81 LTA4H (0.60) LTA4HALDH1A1CYP2D6ATMMAOB
SCHEMBL6160744 0.81 LTA4H (0.50) LTA4HALDH1A1CYP2D6ATMLMNA
SCHEMBL26949212 0.81 LTA4H (0.64) LTA4HALDH1A1MAOBLMNAHPGD
SCHEMBL28131751 0.81 LTA4H (0.64) LTA4HALDH1A1ATMMAOBIDO1
SCHEMBL18613819 0.80 LTA4H (0.58) LTA4HALDH1A1CYP2D6ATMMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114262296-A Method for synthesizing imidazole compounds by using microchannel reaction device 南京工业大学 2022-04-01 CN disclosed
EP-0755923-B1 Ameliorant or remedy for symptoms caused by Ischemic diseases and Phenylpiperidine compounds useful therefor DAIICHI SUNTORY PHARMA CO LTD (JP) 2005-05-04 EP disclosed
US-6469010-B1 COMPOSITION ALSO FOR ALLEVIATION OR TREATMENT OF SYMPTOMS DERIVED FROM SEIZURES, EPILEPSY AND MIGRAINE HEADACHES, AND SUPPRESSION OF CALCIUM ION OVERLOAD SUNTORY LIMITED (JP) 2002-10-22 US disclosed
US-6048876-A ANTICONVULSANTS; ANTIEPILEPIC AGENT SUNTORY LIMITED (JP) 2000-04-11 US disclosed
US-5618980-A DEHYDROGENATING N-CYCLOHEXYLIDENEAMINO COMPOUND IN PRESENCE OF HYDROGEN TRANSFER CATALYST AND HYDROGEN ACCEPTOR AND ALKALI OR ALKALINE EARTH METAL COMPOUND COCATALYST MITSUI TOATSU CHEMICALS, INC. (JP) 1997-04-08 US disclosed
EP-0755923-A1 AMELIORANT OR REMEDY FOR SYMPTOMS CAUSED BY ISCHEMIC DISEASES AND COMPOUNDS USEFUL THEREFOR SUNTORY LIMITED (JP) 1997-01-29 EP disclosed
US-5536878-A HYDROGEN ACCEPTOR MITSUI TOATSU CHEMICALS, INC. (JP) 1996-07-16 US disclosed