SCHEMBL8028682

SCHEMBL8028682

C[C@H]1CC(=O)N(C)CN1C(=O)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.44
ALDH1A1 P00352 3/20 0.44
ABCB1 P08183 1/20 0.43
BRD4 O60885 3/20 0.41
PIK3CD O00329 1/20 0.41
HPGD P15428 2/20 0.41
GAA P10253 1/20 0.41
TSHR P16473 1/20 0.40
RECQL P46063 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
PLA2G1B P04054 1/20 0.40
ATG4B Q9Y4P1 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
SCHEMBL252505 0.76 ACHE (0.55) ACHEALDH1A1ABCB1PIK3CDHPGD
SCHEMBL10938522 0.74 ACHE (0.53) ACHEALDH1A1ABCB1PIK3CDHPGD
SCHEMBL1690525 0.73 LMNA (0.54) ACHEALDH1A1ABCB1GAASMN1; SMN2
SCHEMBL18970120 0.73 LMNA (0.54) ACHEALDH1A1ABCB1GAASMN1; SMN2
SCHEMBL19454030 0.71 HPGD (0.64) ACHEHPGDGAATSHRRECQL
SCHEMBL19453836 0.71 PIK3CD (0.50) ACHEALDH1A1ABCB1PIK3CDHPGD
SCHEMBL18435999 0.70 ACHE (0.49) ACHEALDH1A1PIK3CDHPGDSMN1; SMN2
SCHEMBL11605536 0.70 ACHE (0.49) ACHEALDH1A1ABCB1PIK3CDHPGD
SCHEMBL18080914 0.70 SMO (0.53) ACHEHPGDGAATSHRRECQL
SCHEMBL23018151 0.70 KMT2A (0.42) ALDH1A1BRD4TSHR

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6121325-A Naphthyl compounds promote release of growth hormone MERCK & CO., INC. (US) 2000-09-19 US disclosed
EP-0730578-A4 INDOLYL GROUP CONTAINING COMPOUNDS AND THE USE THEREOF TO PROMOTE THE RELEASE OF GROWTH HORMONE(S) MERCK & CO INC (US) 1997-10-08 EP disclosed
US-5663171-A FOR USE IN HUMANS OR ANIMALS MERCK & CO., INC. (US) 1997-09-02 US disclosed
EP-0730578-A1 INDOLYL GROUP CONTAINING COMPOUNDS AND THE USE THEREOF TO PROMOTE THE RELEASE OF GROWTH HORMONE(S) MERCK & CO. INC. (US) 1996-09-11 EP disclosed
WO-1995014666-A1 INDOLYL GROUP CONTAINING COMPOUNDS AND THE USE THEREOF TO PROMOTE THE RELEASE OF GROWTH HORMONE(S) MERCK & CO., INC. (US) 1995-06-01 WO disclosed