SCHEMBL4620879

SCHEMBL4620879

CC(C)COC(=O)N1CCC(Oc2ccc(Br)cc2)CC1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 8/20 0.47
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
GAA P10253 1/20 0.46
CCR5 P51681 1/20 0.44
ALDH1A1 P00352 1/20 0.44
NAMPT P43490 1/20 0.43
CHRM2 P08172 1/20 0.43
CHRM1 P11229 1/20 0.43
POLB P06746 1/20 0.43
HRH3 Q9Y5N1 1/20 0.43

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
SCHEMBL4662204 0.88 GPR119 (0.47) GPR119KMT2ANAMPTCHRM2CHRM1
SCHEMBL3399260 0.86 GPR119 (0.47) GPR119KMT2AMEN1HRH3
SCHEMBL7390760 0.84 LIPE (0.55) GPR119KMT2APOLB
SCHEMBL7396050 0.83 KMT2A (0.50) GPR119KMT2AMEN1GAAALDH1A1
SCHEMBL865044 0.83 GPR119 (0.56) GPR119CCR5ALDH1A1CHRM2
SCHEMBL31112160 0.82 HRH2 (0.49) GPR119KMT2AMEN1GAACCR5
SCHEMBL2556476 0.81 GPR119 (0.69) GPR119CHRM2CHRM1
SCHEMBL2556948 0.81 GPR119 (0.69) GPR119CHRM2CHRM1
SCHEMBL2457230 0.81 FAAH (0.51) GPR119KMT2AMEN1CCR5ALDH1A1
SCHEMBL2460397 0.81 POLB (0.47) GPR119KMT2AMEN1GAACCR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1883636-A1 SUBSTITUTED PIPERIDINE ANTAGONIST OF HI RECEPTOR TO BE USED FOR THE TREATMENT OF RHINITIS GLAXO GROUP LIMITED (GB) 2008-02-06 EP disclosed
WO-2006125665-A1 SUBSTITUTED PIPERIDINE ANTAGONIST OF HI RECEPTOR TO BE USED FOR THE TREATMENT OF RHINITIS GLAXO GROUP LIMITED (GB) 2006-11-30 WO disclosed