SCHEMBL7908155

SCHEMBL7908155

CN(Cc1ccccc1)C1CCC(CCCCOC(=O)C(=O)O)CC1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 1/20 0.43
JAK1 P23458 1/20 0.43
ITGB3 P05106 2/20 0.41
ITGA2B P08514 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
KMT2A Q03164 1/20 0.39
GRIN2B Q13224 1/20 0.39
HPGD P15428 1/20 0.39
NAAA Q02083 1/20 0.38
SLC18A3 Q16572 1/20 0.38
AGTR2 P50052 2/20 0.38
NPC1 O15118 1/20 0.38
MMP2 P08253 1/20 0.37
BMP1 P13497 1/20 0.37
ACHE P22303 1/20 0.37

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
SCHEMBL7908154 1.00 JAK2 (0.43) JAK2JAK1ITGB3ITGA2BL3MBTL1
Oxalic Acid SCHEMBL7908151 0.83 JAK2 (0.43) JAK2JAK1KMT2AGRIN2BHPGD
Oxalic Acid SCHEMBL7908156 0.83 JAK2 (0.43) JAK2JAK1KMT2AGRIN2BHPGD
Oxalic Acid SCHEMBL7917829 0.80 ALOX5 (0.44) JAK2JAK1L3MBTL1KMT2ANPC1
Oxalic Acid SCHEMBL7917823 0.80 ALOX5 (0.44) JAK2JAK1L3MBTL1KMT2ANPC1
SCHEMBL7918443 0.79 ALOX5 (0.46) JAK2JAK1L3MBTL1KMT2ANPC1
SCHEMBL7918436 0.79 ALOX5 (0.46) JAK2JAK1L3MBTL1KMT2ANPC1
Oxalic Acid SCHEMBL7916381 0.76 JAK2 (0.41) JAK2JAK1L3MBTL1KMT2AGRIN2B
SCHEMBL7908300 0.75 GRIN2B (0.44) JAK2JAK1GRIN2BNAAASLC18A3
SCHEMBL7908299 0.75 GRIN2B (0.44) JAK2JAK1GRIN2BNAAASLC18A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6211219-B1 DRUGS, ANALGESICS AND AGONISTS MERCK SHARP & DOHME LTD. (GB) 2001-04-03 US disclosed