SCHEMBL9066841

SCHEMBL9066841

CC(C)(C)OC(=O)N1CCN(C(=O)C2CNCCO2)CC1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.49
USP2 O75604 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
HPGD P15428 1/20 0.45
KDM4E B2RXH2 1/20 0.42
MAPT P10636 1/20 0.42
THRB P10828 1/20 0.42
SSTR4 P31391 2/20 0.40
EPHX2 P34913 1/20 0.39
EPHX1 P07099 1/20 0.37
DDB1 Q16531 1/20 0.37
CRBN Q96SW2 1/20 0.37

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
SCHEMBL1022316 0.79 RECQL (0.56) RECQLUSP2SMN1; SMN2HPGDKDM4E
SCHEMBL4327248 0.78 USP2 (0.44) RECQLUSP2SMN1; SMN2HPGDKDM4E
SCHEMBL13012231 0.78 SSTR4 (0.42) RECQLSMN1; SMN2HPGDKDM4ESSTR4
SCHEMBL22233403 0.77 RECQL (0.48) RECQLUSP2SMN1; SMN2HPGDKDM4E
SCHEMBL30860003 0.77 CHRNB2 (0.53) RECQLHPGDKDM4ESSTR4
SCHEMBL31464974 0.77 CHRNB2 (0.53) RECQLHPGDKDM4ESSTR4
SCHEMBL25262250 0.76 SSTR4 (0.48) SSTR4
Hydrochloric Acid SCHEMBL15322193 0.76 SSTR4 (0.41) RECQLSMN1; SMN2HPGDKDM4ESSTR4
Hydrochloric Acid SCHEMBL15322195 0.76 SSTR4 (0.41) RECQLSMN1; SMN2HPGDKDM4ESSTR4
SCHEMBL15408885 0.76 SSTR4 (0.38) SMN1; SMN2SSTR4

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-0690713-A1 SUBSTITUTED ALICYCLIC AMINE-CONTAINING MACROCYCLIC IMMUNOMODULATORS ABBOTT LABORATORIES (US) 1996-01-10 EP disclosed
WO-1994021254-A1 SUBSTITUTED ALICYCLIC AMINE-CONTAINING MACROCYCLIC IMMUNOMODULATORS ABBOTT LABORATORIES (US) 1994-09-29 WO disclosed