SCHEMBL7841536

SCHEMBL7841536

c1ccc(CNC2CCN(c3ccccc3)CC2)cc1

nearest known ligand 0.66

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ACHE P22303 11/20 0.66
BACE1 P56817 11/20 0.66
BCHE P06276 8/20 0.66
VCP P55072 1/20 0.58
MEN1 O00255 3/20 0.57
KMT2A Q03164 3/20 0.57
CARM1 Q86X55 1/20 0.57
PRMT6 Q96LA8 1/20 0.57
GRIN2B Q13224 2/20 0.57
FABP6 P51161 1/20 0.54
RAB9A P51151 1/20 0.53
MOGAT2 Q3SYC2 2/20 0.52

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
SCHEMBL13573605 0.91 ACHE (0.55) ACHEBACE1BCHEVCPMEN1
SCHEMBL8355347 0.89 ACHE (0.57) ACHEBACE1BCHEVCPMEN1
SCHEMBL22815725 0.89 ACHE (0.70) ACHEBACE1BCHEVCPMEN1
SCHEMBL7837850 0.89 VCP (0.60) ACHEBACE1BCHEVCPMEN1
SCHEMBL7839245 0.85 VCP (0.59) ACHEBACE1BCHEVCPMEN1
SCHEMBL3958384 0.85 DRD4 (0.56) ACHEBACE1BCHEVCPMEN1
SCHEMBL7844261 0.83 VCP (0.60) ACHEBACE1BCHEVCPGRIN2B
SCHEMBL663239 0.81 GRIN2B (0.74) ACHEBACE1BCHEMEN1KMT2A
SCHEMBL13798544 0.81 CHRNA7 (0.50) ACHEBACE1BCHEVCPMEN1
SCHEMBL8081164 0.81 ACHE (0.68) ACHEBACE1BCHEMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1705670-A 2, 3-dihydro-6-nitroimidazo [2, 1-b ] oxazole compounds OTSUKA PHARMA CO LTD (JP) 2005-12-07 CN disclosed
EP-0944388-A4 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO INC (US) 2001-08-16 EP disclosed
US-6248756-B1 Inhibitors of farnesyl-protein transferase MERCK & CO., INC. 2001-06-19 US disclosed
EP-0944388-A2 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 1999-09-29 EP disclosed
US-5891889-A Inhibitors of farnesyl-protein transferase MERCK & CO., INC. (US) 1999-04-06 US disclosed
WO-1997038665-A2 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1997-10-23 WO disclosed