SCHEMBL8544747

SCHEMBL8544747

O=C(CCc1ccc(Cl)cc1)N1CCC(CCCl)CC1

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.52
MAPT P10636 1/20 0.52
KMT2A Q03164 1/20 0.52
FAAH O00519 2/20 0.50
POLB P06746 1/20 0.50
ME2 P23368 1/20 0.49
ME1 P48163 1/20 0.49
ME3 Q16798 1/20 0.49
NPC1 O15118 2/20 0.48
RAB9A P51151 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
GRIN2B Q13224 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
CNR1 P21554 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
TACR1 P25103 1/20 0.45
CYP2D6 P10635 1/20 0.45
MAOB P27338 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
SCHEMBL8540143 0.89 MEN1 (0.52) MEN1MAPTKMT2AFAAHPOLB
SCHEMBL8541862 0.88 POLB (0.66) MEN1MAPTKMT2AFAAHPOLB
SCHEMBL13504053 0.82 SMN1; SMN2 (0.69) MEN1MAPTKMT2APOLBME2
SCHEMBL8539110 0.80 FAAH (0.64) MEN1MAPTKMT2AFAAHPOLB
SCHEMBL8540403 0.79 TBXAS1 (0.46) MEN1MAPTKMT2AFAAHME2
SCHEMBL13504080 0.78 FKBP1A (0.53) MEN1MAPTKMT2APOLBME2
SCHEMBL8541652 0.78 F10 (0.65) MEN1MAPTKMT2AFAAHME2
SCHEMBL4577206 0.77 CCR3 (0.56) NPC1RAB9ASMN1; SMN2
SCHEMBL17275256 0.77 FAAH (0.60) FAAHNPC1RAB9ASMN1; SMN2L3MBTL1
SCHEMBL1581379 0.77 FAAH (0.60) MAPTFAAHNPC1RAB9ASMN1; SMN2

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
EP-0705258-B1 AZOLYL-CYCLIC AMINE DERIVATIVES WITH IMMUNOMODULATORY ACTIVITY KNOLL AG (DE) 1998-12-30 EP disclosed
US-5741800-A ANTIINFLAMMATORY AGENT, ANTIALLERGENS KNOLL AKTIENGESELLACHAFT (DE) 1998-04-21 US disclosed
EP-0705258-A1 AZOLYL-CYCLIC AMINE DERIVATIVES WITH IMMUNOMODULATORY ACTIVITY Knoll AG (DE) 1996-04-10 EP disclosed
WO-1995000507-A1 AZOLYL-CYCLIC AMINE DERIVATIVES WITH IMMUNOMODULATORY ACTIVITY KNOLL AG (DE) 1995-01-05 WO disclosed