SCHEMBL28059191

SCHEMBL28059191

CCOC(=O)c1cnc(C2CCCCC2)nc1C

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK1D P48730 1/20 0.58
FOS P01100 1/20 0.51
JUN P05412 1/20 0.51
NFKB1 P19838 1/20 0.51
NFKB2 Q00653 1/20 0.51
RELA Q04206 1/20 0.51
NPSR1 Q6W5P4 3/20 0.46
RAB9A P51151 2/20 0.46
NPC1 O15118 3/20 0.46
KDM4E B2RXH2 3/20 0.46
ALDH1A1 P00352 2/20 0.46
LMNA P02545 2/20 0.45
MAPT P10636 2/20 0.45
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
NR2F2 P24468 2/20 0.44
S1PR2 O95136 1/20 0.44
XBP1 P17861 1/20 0.44
PPP1CA P62136 1/20 0.44
OPRK1 P41145 3/20 0.44

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
SCHEMBL30830217 0.88 CSNK1D (0.57) CSNK1DFOSJUNNFKB1NFKB2
SCHEMBL26984530 0.88 CSNK1D (0.57) CSNK1DFOSJUNNFKB1NFKB2
SCHEMBL26984291 0.86 CSNK1D (0.58) CSNK1DFOSJUNNFKB1NFKB2
SCHEMBL31467131 0.85 CSNK1D (0.57) CSNK1DFOSJUNNFKB1NFKB2
SCHEMBL26984630 0.85 CSNK1D (0.57) CSNK1DFOSJUNNFKB1NFKB2
SCHEMBL30830249 0.84 CSNK1D (0.53) CSNK1DFOSJUNNFKB1NFKB2
SCHEMBL26984563 0.84 CSNK1D (0.53) CSNK1DFOSJUNNFKB1NFKB2
SCHEMBL3825413 0.81 FOS (0.56) CSNK1DFOSJUNNFKB1NFKB2
SCHEMBL23779660 0.80 FOS (0.55) CSNK1DFOSJUNNFKB1NFKB2
SCHEMBL4765987 0.79 CSNK1D (0.47) CSNK1DNPSR1RAB9ANPC1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105814022-B Condensed bicyclic heteroaromatic derivative as TNF active regulators UCB生物制药私人有限公司 2018-09-28 CN disclosed
CN-105814025-B Tetrahydrobenzimidazderivative derivative as TNF active regulators UCB生物制药私人有限公司 2018-09-04 CN disclosed
CN-105814052-B Imidazopyridine derivatives as TNF active regulators UCB生物制药私人有限公司 2018-01-12 CN disclosed
CN-105814056-B purine derivatives as modulators of TNF activity UCB生物制药私人有限公司 2017-10-10 CN disclosed
CN-105814045-B Imidazopyridine derivatives as modulators of TNF activity UCB生物制药私人有限公司 2017-08-25 CN disclosed
CN-105829307-A TETRAHYDROIMIDAZOPYRIDINE DERIVATIVES AS MODULATORS OF TNF ACTIVITY UCB生物制药私人有限公司 2016-08-03 CN disclosed
CN-105814025-A Tetrahydrobenzimidazole derivatives as modulators of TNF activity UCB生物制药私人有限公司 2016-07-27 CN disclosed
CN-105814052-A Imidazopyridine derivatives as modulators of TNF activity UCB生物制药私人有限公司 2016-07-27 CN disclosed
CN-105814022-A Fused bicyclic heteroaromatic derivatives as modulators of tnf activity UCB生物制药私人有限公司 2016-07-27 CN disclosed
CN-105814045-A Imidazopyridine derivatives as modulators of TNF activity UCB生物制药私人有限公司 2016-07-27 CN disclosed