SCHEMBL7264336

SCHEMBL7264336

C[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](CCOc1cccc(-c2ccc(Cl)nc2)c1)NC(=O)c1c[nH]cn1

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FAAH O00519 4/20 0.34
ROCK2 O75116 3/20 0.33
MAP4K4 O95819 1/20 0.33
ACACB O00763 1/20 0.32
ACACA Q13085 1/20 0.32
SMN1; SMN2 Q16637 3/20 0.32
TP53 P04637 2/20 0.32
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
CHEK1 O14757 1/20 0.32
CHEK2 O96017 1/20 0.32
SLC5A1 P13866 1/20 0.31
NAAA Q02083 1/20 0.31
MAPT P10636 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
ROCK1 Q13464 2/20 0.30

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
SCHEMBL7258783 0.88 ROCK2 (0.37) FAAHROCK2MAP4K4ACACBACACA
SCHEMBL7258928 0.86 SMN1; SMN2 (0.34) SMN1; SMN2TP53NPC1RAB9ASLC5A1
SCHEMBL7259390 0.85 RAB9A (0.38) SMN1; SMN2TP53NPC1RAB9A
SCHEMBL7264021 0.84 FFAR1 (0.35) SMN1; SMN2NPC1RAB9AMAPT
SCHEMBL7259504 0.84 MCHR1 (0.38) SMN1; SMN2NPC1MAPTHDAC6
SCHEMBL7264648 0.82 BCHE (0.38) SMN1; SMN2TP53NPC1RAB9AHDAC6
SCHEMBL7259442 0.81 MAPT (0.42) SMN1; SMN2TP53NPC1RAB9AMAPT
SCHEMBL7259380 0.81 SMN1; SMN2 (0.39) ROCK2SMN1; SMN2TP53NPC1RAB9A
SCHEMBL7264002 0.81 NPC1 (0.37) NPC1RAB9AMAPT
SCHEMBL7259490 0.80 CNR1 (0.39) ROCK2ACACBACACASMN1; SMN2TP53

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
WO-2003006437-A1 IMIDAZOLE DERIVATIVES AS ADENOSINE DEAMINASE INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-01-23 WO claimed
WO-2003006437-A1 IMIDAZOLE DERIVATIVES AS ADENOSINE DEAMINASE INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-01-23 WO disclosed