SCHEMBL14504152

SCHEMBL14504152

Cc1ccc(CNc2nc(N3CCCCC3)nc(N3CCCCC3)n2)c(C)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 7/20 0.53
▸ SMN1; SMN2 Q16637 3/20 0.53
▸ HTT P42858 3/20 0.51
▸ NPSR1 Q6W5P4 5/20 0.49
▸ MAPT P10636 2/20 0.49
▸ MEN1 O00255 4/20 0.49
▸ KMT2A Q03164 4/20 0.49
▸ GBA1 P04062 3/20 0.48
▸ TSHR P16473 4/20 0.46
▸ ALOX15 P16050 3/20 0.46
▸ ALDH1A1 P00352 2/20 0.46
▸ KDM4E B2RXH2 1/20 0.46
▸ POLB P06746 1/20 0.46
▸ CRHBP P24387 1/20 0.46
▸ CRHR2 Q13324 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.44
▸ GALR2 O43603 1/20 0.44
▸ PTGS2 P35354 1/20 0.43
▸ CYP1A2 P05177 1/20 0.42
▸ CYP2D6 P10635 1/20 0.42

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
SCHEMBL14503258 0.89 LMNA (0.53) LMNASMN1; SMN2HTTNPSR1MAPT
SCHEMBL14503838 0.87 HTT (0.50) LMNASMN1; SMN2HTTNPSR1MEN1
SCHEMBL14503261 0.80 NPSR1 (0.57) LMNASMN1; SMN2HTTNPSR1MAPT
SCHEMBL5384843 0.80 KDM4E (0.39) LMNASMN1; SMN2HTTNPSR1MAPT
SCHEMBL14503260 0.78 LMNA (0.64) LMNASMN1; SMN2HTTNPSR1MAPT
SCHEMBL14503648 0.78 LMNA (0.63) LMNASMN1; SMN2HTTNPSR1MAPT
SCHEMBL14503890 0.77 LMNA (0.54) LMNASMN1; SMN2HTTNPSR1MAPT
SCHEMBL14503885 0.77 LMNA (0.53) LMNASMN1; SMN2HTTNPSR1MAPT
SCHEMBL14503396 0.76 GBA1 (0.51) LMNASMN1; SMN2HTTNPSR1MEN1
SCHEMBL14503873 0.76 KDM4E (0.52) LMNASMN1; SMN2NPSR1MEN1KMT2A

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-7223759-B2 Antibacterial 3,5-diaminopiperidine-substituted aromatic and heteroaromatic compounds ANADYS PHARMACEUTICALS, INC. (US) 2007-05-29 — — US disclosed
US-7223759-B2 Antibacterial 3,5-diaminopiperidine-substituted aromatic and heteroaromatic compounds ANADYS PHARMACEUTICALS, INC. (US) 2007-05-29 — — US disclosed
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