SCHEMBL14530296

SCHEMBL14530296

CN(C)C(=O)[C@H]1CC2(CCN(C(=O)OC(C)(C)C)CC2)c2ccccc21

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ OPRD1 P41143 1/20 0.54
▸ KCNH2 Q12809 1/20 0.54
▸ KDM1A O60341 3/20 0.45
▸ HSD11B1 P28845 1/20 0.43
▸ HDAC1 Q13547 2/20 0.43
▸ HDAC8 Q9BY41 2/20 0.43
▸ HDAC6 Q9UBN7 2/20 0.43
▸ GPR119 Q8TDV5 1/20 0.41
▸ NAE1 Q13564 1/20 0.41
▸ UBA3 Q8TBC4 1/20 0.41
▸ USP30 Q70CQ3 2/20 0.40
▸ TERT O14746 1/20 0.40
▸ TSHR P16473 2/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ ATM Q13315 1/20 0.39
▸ PDK2 Q15119 1/20 0.39
▸ IDO1 P14902 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.38
▸ PKM P14618 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
SCHEMBL14530301 1.00 OPRD1 (0.54) OPRD1KCNH2KDM1AHSD11B1HDAC1
SCHEMBL5313407 0.88 HSD11B1 (0.55) OPRD1KDM1AHSD11B1HDAC1HDAC8
SCHEMBL5314419 0.88 HSD11B1 (0.55) OPRD1KDM1AHSD11B1HDAC1HDAC8
SCHEMBL1222691 0.88 HSD11B1 (0.55) OPRD1KDM1AHSD11B1HDAC1HDAC8
SCHEMBL14272834 0.86 HSD11B1 (0.46) KDM1AHSD11B1HDAC1HDAC8HDAC6
SCHEMBL14300919 0.86 HSD11B1 (0.46) KDM1AHSD11B1HDAC1HDAC8HDAC6
SCHEMBL6588859 0.83 HDAC1 (0.44) KDM1AHSD11B1HDAC1HDAC8HDAC6
SCHEMBL31096660 0.83 KDM1A (0.46) KDM1AHDAC1HDAC8HDAC6GPR119
SCHEMBL3752156 0.83 KDM1A (0.46) KDM1AHDAC1HDAC8HDAC6GPR119
SCHEMBL6394296 0.83 KDM1A (0.46) KDM1AHDAC1HDAC8HDAC6GPR119

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
WO-2007057775-A1 SPIROPIPERIDINE DERIVATIVES PFIZER LIMITED (GB) 2007-05-24 — — WO disclosed
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