SCHEMBL7147634

SCHEMBL7147634

C=COC(=O)N1CC2CCCC(C1)C2C(C)(C)C(=O)O

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.32
CHRNB2 P17787 1/20 0.30
CHRNB4 P30926 1/20 0.30
CHRNA3 P32297 1/20 0.30
CHRNA4 P43681 1/20 0.30

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
SCHEMBL6745486 0.83 CHRM1 (0.35) NR1H2
SCHEMBL6749623 0.81
SCHEMBL6749482 0.77 HSD11B1 (0.34) CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL6749478 0.77 HSD11B1 (0.34) CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL7143739 0.75 NR1H2 (0.36) NR1H2CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL6745589 0.74 HSD11B1 (0.35)
SCHEMBL6778656 0.74 MEN1 (0.39) CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL6778655 0.74 MEN1 (0.39) CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL6750578 0.72 TPSAB1 (0.34)
SCHEMBL6750582 0.72 TPSAB1 (0.34)

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
US-6518423-B1 These compounds are useful as drugs efficacious in the prevention and treatment of these various inflammatory diseases and immunologic diseases, such as rheumatoid arthritis, atopic dermatitis, psoriasis, asthma, and EISAI CO., LTD. (JP) 2003-02-11 US disclosed
EP-0934941-A1 BENZOPIPERIDINE DERIVATIVES Eisai Co., Ltd. (JP) 1999-08-11 EP disclosed