SCHEMBL9645876

SCHEMBL9645876

CCC1CC(CC)N(C)C(=O)N1C

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.50
▸ ADRA2C P18825 1/20 0.43
▸ KDM4E B2RXH2 2/20 0.36
▸ GLA P06280 1/20 0.36
▸ GAA P10253 2/20 0.35
▸ TP53 P04637 1/20 0.35
▸ MEN1 O00255 1/20 0.34
▸ PABPC1 P11940 1/20 0.34
▸ F2 P00734 1/20 0.32
▸ ELANE P08246 1/20 0.32
▸ CTSG P08311 1/20 0.32
▸ CTRC Q99895 1/20 0.32
▸ TSHR P16473 1/20 0.31
▸ MAPK1 P28482 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
SCHEMBL6937742 0.76 KMT2A (0.36) KMT2AADRA2CGAATP53
SCHEMBL25633092 0.75 KMT2A (0.34) KMT2A
SCHEMBL11700347 0.75 KMT2A (0.34) KMT2A
SCHEMBL9646031 0.70 ADRA2C (0.50) KMT2AADRA2CKDM4EGLAGAA
SCHEMBL24538078 0.70 KMT2A (0.31) KMT2A
SCHEMBL8299956 0.70 KMT2A (0.31) KMT2A
SCHEMBL15134296 0.70 — —
SCHEMBL25776359 0.68 — —
SCHEMBL5543698 0.67 — —
SCHEMBL12243288 0.67 — —

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
EP-0356973-B1 PROCESS FOR THE PRODUCTION OF CYCLIC N,N'-DIMETHYL UREAS BASF Aktiengesellschaft (DE) 1992-11-11 — — EP disclosed
US-4970321-A Preparation of cyclic N,N'-dimethylureas BASF AKTIENGESELLSCHAFT (DE) 1990-11-13 — — US disclosed
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