SCHEMBL3665934

SCHEMBL3665934

CCNS(=O)(=O)c1ccc(-c2ccccc2)c(CCN2CCCC2)c1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ SFRP1 Q8N474 1/20 0.48
▸ BRD4 O60885 1/20 0.44
▸ SRC P12931 1/20 0.44
▸ L3MBTL1 Q9Y468 2/20 0.42
▸ MBTD1 Q05BQ5 1/20 0.42
▸ SLC2A1 P11166 1/20 0.41
▸ HTR6 P50406 1/20 0.41
▸ SIGMAR1 Q99720 5/20 0.41
▸ PARP1 P09874 3/20 0.41
▸ KCNH2 Q12809 1/20 0.40
▸ HRH3 Q9Y5N1 1/20 0.40
▸ IKBKB O14920 1/20 0.40
▸ CHUK O15111 1/20 0.40

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
SCHEMBL3987022 0.83 KCNH2 (0.63) KCNH2HRH3
SCHEMBL3326933 0.74 HRH3 (0.67) L3MBTL1MBTD1SIGMAR1KCNH2HRH3
SCHEMBL13038379 0.71 SIGMAR1 (0.45) SIGMAR1HRH3
SCHEMBL12991519 0.71 TRPV1 (0.51) —
SCHEMBL14842018 0.71 CA2 (0.40) —
Water SCHEMBL14842096 0.70 CA2 (0.40) —
SCHEMBL3591883 0.70 KCNH2 (0.51) KCNH2HRH3
SCHEMBL30513622 0.68 CA2 (0.52) —
SCHEMBL7066933 0.68 MMP1 (0.64) —
SCHEMBL3914577 0.67 HRH3 (0.53) KCNH2HRH3

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-2152669-A1 PROCESSES FOR PREPARING (R)-2-METHYLPYRROLIDINE AND (S)-2-METHYLPYRROLIDINE AND TARTRATE SALTS THEREOF Cephalon, Inc. (US) 2010-02-17 — — EP disclosed
WO-2008137087-A1 PROCESSES FOR PREPARING (R)-2-METHYLPYRROLIDINE AND (S)-2-METHYLPYRROLIDINE AND TARTRATE SALTS THEREOF CEPHALON, INC. (US) 2008-11-13 — — WO disclosed
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