SCHEMBL28018666

SCHEMBL28018666

CC(C)(CCC1CCCCC1O)OC(N)=O

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 3/20 0.44
▸ CA2 P00918 3/20 0.44
▸ CA4 P22748 3/20 0.44
▸ TSHR P16473 1/20 0.32
▸ CA6 P23280 2/20 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
SCHEMBL27905600 0.84 CA1 (0.39) CA1CA2CA4TSHR
SCHEMBL27888905 0.84 CA1 (0.39) CA1CA2CA4TSHR
SCHEMBL28097052 0.79 CHRM2 (0.30) —
SCHEMBL27737557 0.78 — —
SCHEMBL27737553 0.78 — —
SCHEMBL3603125 0.72 CHRM2 (0.33) —
SCHEMBL27593040 0.72 NR1H2 (0.37) —
SCHEMBL27593232 0.72 LMNA (0.30) —
SCHEMBL27611213 0.72 LMNA (0.40) —
SCHEMBL27896511 0.72 HTR4 (0.36) TSHR

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
CN-104619698-B Pyrrolidin derivatives and the purposes as complement pathway regulator thereof 诺华股份有限公司 2016-08-31 — — CN disclosed
CN-104619698-A Pyrrolidine derivatives and their use as complement pathway modulators NOVARTIS AG 2015-05-13 — — CN disclosed
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