SCHEMBL7015188

SCHEMBL7015188

CC(=O)C(C1CCOCC1)S(=O)(=O)N1CCC(c2ccc(F)cc2)CC1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
USP5 P45974 1/20 0.41
NAMPT P43490 1/20 0.40
FAAH O00519 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
CCR1 P32246 2/20 0.38
SLC6A9 P48067 1/20 0.37
PKM P14618 1/20 0.36
CCR5 P51681 1/20 0.36
NPC1 O15118 1/20 0.35
MAPT P10636 1/20 0.35
RAB9A P51151 1/20 0.35
COMT P21964 1/20 0.35
ADAMTS5 Q9UNA0 1/20 0.35
DPP4 P27487 1/20 0.35
DPP8 Q6V1X1 1/20 0.35
DPP9 Q86TI2 1/20 0.35
HCRTR2 O43614 1/20 0.35
FASN P49327 1/20 0.35

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
SCHEMBL7017112 0.89 MMP2 (0.42) USP5SMN1; SMN2CCR1
SCHEMBL941517 0.70 MMP3 (0.45) USP5NAMPTFAAHSMN1; SMN2PKM
SCHEMBL12911295 0.70 MMP3 (0.52) USP5NAMPTSMN1; SMN2CCR1PKM
SCHEMBL942270 0.70 DPP4 (0.49) USP5NAMPTSMN1; SMN2CCR5COMT
SCHEMBL4698592 0.70 USP5 (0.50) USP5NAMPTFAAHCCR1CCR5
SCHEMBL7020098 0.69 MMP1 (0.53) NAMPT
SCHEMBL4698427 0.68 USP5 (0.48) USP5NAMPTCCR1CCR5NPC1
SCHEMBL7014329 0.68 COMT (0.44) USP5NAMPTSMN1; SMN2CCR1CCR5
SCHEMBL6265718 0.68 FAAH (0.41) FAAHSMN1; SMN2SLC6A9
SCHEMBL10460507 0.67 QDPR (0.62) FAAHCCR1NPC1MAPTRAB9A

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
EP-1370536-A1 METALLOPROTEINASE INHIBITORS AstraZeneca AB (SE) 2003-12-17 EP disclosed
WO-2002074750-A1 METALLOPROTEINASE INHIBITORS ASTRAZENECA AB (SE) 2002-09-26 WO disclosed