SCHEMBL10439232

SCHEMBL10439232

CCCCC#Cc1ccc(C(=O)Nc2ccc(O)cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 1/20 0.48
MMP12 P39900 1/20 0.48
MAPT P10636 2/20 0.47
SNCA P37840 1/20 0.47
DEGS1 O15121 1/20 0.47
LMNA P02545 2/20 0.46
STAT3 P40763 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
TRPV1 Q8NER1 1/20 0.46
BDKRB2 P30411 1/20 0.45
HDAC3 O15379 1/20 0.45
HDAC1 Q13547 1/20 0.45
HDAC2 Q92769 1/20 0.45
NCOR2 Q9Y618 1/20 0.45
TNK2 Q07912 1/20 0.44
NQO2 P16083 2/20 0.44
KDM4E B2RXH2 1/20 0.44
MEN1 O00255 1/20 0.43
USP2 O75604 1/20 0.43
POLB P06746 1/20 0.43

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
SCHEMBL10439472 0.86 DEGS1 (0.46) MAPTSNCADEGS1LMNANQO2
SCHEMBL7031654 0.81 FFAR1 (0.50) MMP2MMP12LMNATNK2KDM4E
SCHEMBL10439469 0.81 DEGS1 (0.50) MAPTDEGS1SMN1; SMN2HDAC3HDAC1
SCHEMBL10876762 0.78 SMN1; SMN2 (0.72) MAPTLMNASTAT3SMN1; SMN2KDM4E
SCHEMBL10439256 0.77 LMNA (0.51) MMP2DEGS1LMNASMN1; SMN2KDM4E
SCHEMBL10439244 0.76 DEGS1 (0.69) SNCADEGS1HDAC2NQO2KDM4E
SCHEMBL8756748 0.75 HSD17B3 (0.73) MAPTSNCADEGS1TRPV1BDKRB2
SCHEMBL4751447 0.75 TRPV1 (0.69) LMNATRPV1BDKRB2KDM4E
SCHEMBL8391647 0.75 FFAR1 (0.59) MMP2MMP12LMNATNK2KDM4E
SCHEMBL5036576 0.75 FFAR1 (0.59) MMP2MMP12LMNATNK2KDM4E

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
EP-0361772-A2 Cyclopentyl ethers and their preparation and pharmaceutical formulation GLAXO GROUP LIMITED (GB) 1990-04-04 EP disclosed