SCHEMBL9764529

SCHEMBL9764529

O=C(N(CCCCCCOCCc1ccc(N2CCOCC2)cc1)Cc1ccccc1)C(F)(F)F

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.45
MAPT P10636 1/20 0.41
NAMPT P43490 4/20 0.40
MEN1 O00255 1/20 0.40
POLB P06746 1/20 0.40
KMT2A Q03164 1/20 0.40
SLC13A5 Q86YT5 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
FFAR4 Q5NUL3 3/20 0.38
RORC P51449 1/20 0.38
HRH4 Q9H3N8 1/20 0.38
HRH3 Q9Y5N1 1/20 0.38

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
SCHEMBL9763263 0.97 L3MBTL1 (0.45) L3MBTL1MAPTNAMPTMEN1POLB
SCHEMBL9763598 0.93 FFAR4 (0.43) MAPTSMN1; SMN2FFAR4HRH4HRH3
SCHEMBL9762903 0.82 FAAH (0.42)
SCHEMBL9763406 0.79 FAAH (0.46)
SCHEMBL9762547 0.79 KCNH2 (0.53) MAPTMEN1KMT2ASMN1; SMN2HRH4
SCHEMBL9763073 0.78 FAAH (0.39)
SCHEMBL9763575 0.78 SPHK1 (0.43) NAMPT
SCHEMBL9762900 0.77 FAAH (0.38) HRH4HRH3
SCHEMBL9763654 0.75 FAAH (0.39) L3MBTL1HRH4HRH3
SCHEMBL9763665 0.73 SNCA (0.44) L3MBTL1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5006556-A Dichloroaniline derivatives for the therapy or prophylaxysis of a disease associated with reversible airway obstruction GLAXO GROUP LIMITED (GB) 1991-04-09 US disclosed
US-4943591-A TREATMENT OF ASTHMA AND BRONCHITIS GLAXO GROUP LIMITED (GB) 1990-07-24 US disclosed
EP-0181709-B1 DICHLOROANILINE DERIVATIVES GLAXO GROUP LIMITED (GB) 1990-05-09 EP disclosed
EP-0181709-A1 Dichloroaniline Derivatives GLAXO GROUP LIMITED (GB) 1986-05-21 EP disclosed