SCHEMBL10902157

SCHEMBL10902157

CCOC(=O)c1ccc(CCN2CCN(C(=O)C=Cc3ccc(Cl)cc3)CC2)cc1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR183 P32249 7/20 0.55
GAA P10253 1/20 0.55
KMT2A Q03164 2/20 0.54
MEN1 O00255 1/20 0.54
KCNJ1 P48048 1/20 0.54
KCNH2 Q12809 1/20 0.54
EBP Q15125 1/20 0.53
SIGMAR1 Q99720 1/20 0.53
HTT P42858 2/20 0.50
DHCR7 Q9UBM7 1/20 0.50
ALDH1A1 P00352 1/20 0.48
LMNA P02545 1/20 0.48
MAPT P10636 1/20 0.48
HPGD P15428 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
SCHEMBL10902153 1.00 GPR183 (0.55) GPR183GAAKMT2AMEN1KCNJ1
SCHEMBL10901880 0.89 GPR183 (0.56) GPR183GAAKMT2AMEN1EBP
SCHEMBL10901877 0.89 GPR183 (0.56) GPR183GAAKMT2AMEN1EBP
SCHEMBL10900513 0.86 EBP (0.73) GAAKMT2AMEN1KCNJ1KCNH2
SCHEMBL10900512 0.86 EBP (0.73) GAAKMT2AMEN1KCNJ1KCNH2
SCHEMBL10900566 0.85 EBP (0.72) GPR183GAAKMT2AMEN1EBP
SCHEMBL10900561 0.85 EBP (0.72) GPR183GAAKMT2AMEN1EBP
SCHEMBL10900781 0.84 KCNJ1 (0.59) KMT2AMEN1KCNJ1KCNH2SIGMAR1
SCHEMBL10899492 0.84 THRB (0.65) GPR183KMT2AMEN1KCNJ1KCNH2
SCHEMBL10897540 0.83 ACHE (0.59) GPR183GAAKMT2AMEN1KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4616086-A ANTICOAGULANTS BOEHRINGER MANNHEIM GMBH (DE) 1986-10-07 US disclosed