SCHEMBL14456961

SCHEMBL14456961

CC(c1ccncc1)N1CCC(C(=O)N2CCN(S(=O)(=O)N(C)C)CC2)CC1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ LSS P48449 3/20 0.46
▸ ALDH1A1 P00352 2/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ F10 P00742 1/20 0.41
▸ ITGB3 P05106 1/20 0.41
▸ ITGA2B P08514 1/20 0.41
▸ SORD Q00796 2/20 0.39
▸ POLB P06746 1/20 0.39
▸ HPGD P15428 1/20 0.39

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
SCHEMBL14456969 0.86 TBK1 (0.41) ALDH1A1L3MBTL1SORD
SCHEMBL14456962 0.81 CNR1 (0.65) LSSALDH1A1L3MBTL1F10
SCHEMBL14456954 0.79 ALDH1A1 (0.55) ALDH1A1POLB
SCHEMBL14515115 0.74 LTA4H (0.52) ALDH1A1ITGB3ITGA2BHPGD
SCHEMBL13391737 0.74 MGLL (0.52) POLB
SCHEMBL14356016 0.74 MGLL (0.52) POLB
SCHEMBL13003540 0.73 KDM4D (0.48) ALDH1A1ITGB3ITGA2B
SCHEMBL14456699 0.73 ACKR3 (0.44) —
SCHEMBL14456704 0.72 KDM4E (0.48) ALDH1A1HPGD
SCHEMBL8225769 0.72 KDM4D (0.50) ITGB3ITGA2B

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-7238688-B2 Piperidine compounds SCHERING CORPORATION (US) 2007-07-03 — — US disclosed
US-7238688-B2 Piperidine compounds SCHERING CORPORATION (US) 2007-07-03 — — US disclosed
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