SCHEMBL8311424

SCHEMBL8311424

CC(C)(C)OC(=O)N1CCC2(CC1)CC(C(=O)OCc1ccccc1)c1ccccc12

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ HDAC1 Q13547 2/20 0.44
▸ HDAC8 Q9BY41 2/20 0.44
▸ HDAC6 Q9UBN7 2/20 0.44
▸ TACR1 P25103 1/20 0.42
▸ OPRD1 P41143 1/20 0.42
▸ OPRK1 P41145 1/20 0.42
▸ HSD11B1 P28845 1/20 0.42
▸ STS P08842 1/20 0.42
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ YAP1 P46937 1/20 0.41
▸ KDM1A O60341 1/20 0.41
▸ NAE1 Q13564 1/20 0.40
▸ UBA3 Q8TBC4 1/20 0.40
▸ GPR119 Q8TDV5 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ NAMPT P43490 1/20 0.40

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
SCHEMBL6588859 0.89 HDAC1 (0.44) HDAC1HDAC8HDAC6HSD11B1KDM1A
SCHEMBL14300919 0.86 HSD11B1 (0.46) HDAC1HDAC8HDAC6HSD11B1KDM1A
SCHEMBL14272834 0.86 HSD11B1 (0.46) HDAC1HDAC8HDAC6HSD11B1KDM1A
SCHEMBL1222691 0.85 HSD11B1 (0.55) HDAC1HDAC8HDAC6TACR1OPRD1
SCHEMBL5314419 0.85 HSD11B1 (0.55) HDAC1HDAC8HDAC6TACR1OPRD1
SCHEMBL5313407 0.85 HSD11B1 (0.55) HDAC1HDAC8HDAC6TACR1OPRD1
SCHEMBL8315315 0.85 HSD11B1 (0.46) HDAC1HDAC8HDAC6TACR1OPRD1
SCHEMBL8314335 0.84 KDM1A (0.44) HDAC1HDAC8HDAC6OPRD1OPRK1
SCHEMBL7623319 0.84 KDM1A (0.44) HDAC1HDAC8HDAC6OPRD1OPRK1
SCHEMBL14530296 0.81 OPRD1 (0.54) HDAC1HDAC8HDAC6OPRD1HSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0662481-B1 Spiro piperidines and homologs promote release of growth hormone MERCK & CO INC (US) 1999-03-24 — — EP disclosed
US-5578593-A RELEASING GROWTH HORMONES FOR ANIMALS MERCK & CO., INC. (US) 1996-11-26 — — US disclosed
EP-0662481-A1 Spiro piperidines and homologs promote release of growth hormone MERCK & CO. INC. (US) 1995-07-12 — — EP disclosed
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