SCHEMBL6421345

SCHEMBL6421345

CC(C)(C)OC(=O)N1CCc2c(n(Cc3ccccc3)c3ccccc23)C1

nearest known ligand 0.67

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 2/20 0.67
HDAC6 Q9UBN7 2/20 0.67

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
SCHEMBL6421094 0.88 PTGDR2 (0.59) HDAC1HDAC6
SCHEMBL6421118 0.86 HDAC1 (0.55) HDAC1HDAC6
SCHEMBL6421798 0.86 HDAC1 (0.55) HDAC1HDAC6
SCHEMBL6423329 0.85 HDAC1 (0.55) HDAC1HDAC6
SCHEMBL9615138 0.84 HDAC6 (0.64) HDAC1HDAC6
SCHEMBL6420742 0.84 HDAC1 (0.54) HDAC1HDAC6
SCHEMBL6422016 0.84 HDAC1 (0.54) HDAC1HDAC6
SCHEMBL4185797 0.84 HDAC1 (0.56) HDAC1HDAC6
SCHEMBL6423858 0.83 HDAC1 (0.53) HDAC1HDAC6
SCHEMBL6424243 0.83 HDAC1 (0.55) HDAC1HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1057814-B1 TETRAHYDROBENZINDOLE DERIVATIVES MEIJI SEIKA KAISHA (JP) 2005-03-09 EP disclosed
US-6498251-B1 Tetrahydrobenzindole derivatives MEIJI SEIKA KAISHA, LTD. (JP) 2002-12-24 US disclosed
EP-1057814-A1 TETRAHYDROBENZINDOLE DERIVATIVES Meiji Seika Kaisha, Ltd. (JP) 2000-12-06 EP disclosed
US-6057311-A TREATING EATING DISORDERS JAMES BLACK FOUNDATION LIMITED (GB) 2000-05-02 US disclosed
WO-1997032860-A1 BENZODIAZONINE DERIVATIVES BINDING TO CHOLECYSTOKININ OR GASTRIN RECEPTORS JAMES BLACK FOUNDATION LIMITED (GB) 1997-09-12 WO disclosed