SCHEMBL7841491

SCHEMBL7841491

CCCCOC(=O)N1CCC(C(=O)O)CC1CCCC

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.40
POLB P06746 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
S1PR5 Q9H228 11/20 0.39
GBA2 Q9HCG7 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.34
S1PR1 P21453 7/20 0.33
ALDH1A1 P00352 1/20 0.33
ECE1 P42892 1/20 0.33
S1PR3 Q99500 5/20 0.33
S1PR4 O95977 1/20 0.33
GAA P10253 1/20 0.33
CHRM2 P08172 1/20 0.32
CHRM1 P11229 1/20 0.32

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
SCHEMBL4748923 0.76 RAB9A (0.50) LMNAPOLBSMN1; SMN2S1PR5GBA2
SCHEMBL7406503 0.76 GBA2 (0.49) LMNAPOLBSMN1; SMN2GBA2L3MBTL1
SCHEMBL2170278 0.76 GBA2 (0.49) LMNAPOLBSMN1; SMN2GBA2L3MBTL1
SCHEMBL7478389 0.76 GBA2 (0.49) LMNAPOLBSMN1; SMN2GBA2L3MBTL1
SCHEMBL7672219 0.76 RAB9A (0.50) LMNAPOLBSMN1; SMN2S1PR5GBA2
SCHEMBL5491802 0.76 RAB9A (0.50) LMNAPOLBSMN1; SMN2S1PR5GBA2
SCHEMBL355693 0.76 SMN1; SMN2 (0.58) LMNAPOLBSMN1; SMN2S1PR5L3MBTL1
SCHEMBL8089152 0.75 GAA (0.33) POLBL3MBTL1ALDH1A1GAACHRM2
SCHEMBL29948421 0.74 GAA (0.41) LMNAPOLBSMN1; SMN2GBA2ALDH1A1
SCHEMBL28037367 0.73 POLB (0.35) POLBSMN1; SMN2S1PR5S1PR1S1PR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0944388-A4 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO INC (US) 2001-08-16 EP disclosed
EP-0944388-A2 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 1999-09-29 EP disclosed
WO-1997038665-A2 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1997-10-23 WO disclosed