SCHEMBL16403966

SCHEMBL16403966

Cc1nc(-c2cc(C(=O)N3CCC(c4nc5ccccc5o4)CC3)n(C)c2)cs1

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 7/20 0.55
▸ HTR2B P41595 1/20 0.54
▸ THRB P10828 2/20 0.52
▸ NPSR1 Q6W5P4 2/20 0.49
▸ MAPT P10636 1/20 0.49
▸ USP2 O75604 1/20 0.49
▸ TP53 P04637 2/20 0.49
▸ ALDH1A1 P00352 1/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.49
▸ POLB P06746 2/20 0.48

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
SCHEMBL16403916 0.80 ALDH1A1 (0.48) LMNANPSR1MAPTUSP2ALDH1A1
SCHEMBL16403992 0.77 RAB9A (0.60) LMNANPSR1ALDH1A1SMN1; SMN2POLB
SCHEMBL16403979 0.77 MGLL (0.48) LMNAMAPTUSP2TP53ALDH1A1
SCHEMBL16403927 0.73 ALDH1A1 (0.49) LMNAMAPTALDH1A1SMN1; SMN2POLB
SCHEMBL16403918 0.73 NPC1 (0.47) LMNAMAPTALDH1A1SMN1; SMN2
SCHEMBL17689220 0.71 LMNA (0.64) LMNAHTR2BTHRBNPSR1MAPT
SCHEMBL5014847 0.70 LMNA (0.73) LMNAHTR2BTHRBNPSR1MAPT
SCHEMBL14318296 0.70 HPGD (0.45) ALDH1A1
SCHEMBL14684786 0.69 KCNA5 (0.54) TP53ALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL13810503 0.68 LMNA (0.61) LMNAHTR2BTHRBNPSR1MAPT

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-8937065-B2 Compositions and methods for modulating a kinase CLEVEXEL PHARMA (FR) 2015-01-20 — — US disclosed
US-8937065-B2 Compositions and methods for modulating a kinase CLEVEXEL PHARMA (FR) 2015-01-20 — — US disclosed
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