SCHEMBL7969831

SCHEMBL7969831

CCOC(=O)c1cc2c(n1Cc1ccc(Cl)c(Cl)c1)CCC2

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.47
SMN1; SMN2 Q16637 4/20 0.47
LMNA P02545 4/20 0.47
HTT P42858 2/20 0.47
GAA P10253 1/20 0.47
ALDH1A1 P00352 4/20 0.47
KDM4E B2RXH2 2/20 0.47
TDP1 Q9NUW8 4/20 0.46
MAPK1 P28482 2/20 0.46
NPSR1 Q6W5P4 2/20 0.46
RAB9A P51151 1/20 0.46
NOD2 Q9HC29 1/20 0.45
NOD1 Q9Y239 1/20 0.45
TSHR P16473 3/20 0.43
POLB P06746 2/20 0.42
CCR2 P41597 4/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
ABCB11 O95342 1/20 0.41

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
SCHEMBL7047270 0.99 MAPT (0.48) MAPTSMN1; SMN2LMNAHTTGAA
SCHEMBL9098048 0.86 MAPT (0.55) MAPTSMN1; SMN2LMNAGAAALDH1A1
SCHEMBL7947056 0.83 CCR2 (0.55) MAPTLMNARAB9ACCR2ABCB11
SCHEMBL7052102 0.82 CCR2 (0.56) CCR2ABCB11
SCHEMBL7954271 0.77 LMNA (0.50) MAPTSMN1; SMN2LMNAHTTGAA
SCHEMBL6307761 0.77 NOD2 (0.60) MAPTSMN1; SMN2LMNAHTTGAA
SCHEMBL6302415 0.77 MAPT (0.51) MAPTSMN1; SMN2LMNAHTTGAA
SCHEMBL7046362 0.77 HDAC1 (0.51) MAPTSMN1; SMN2LMNAHTTGAA
SCHEMBL12584597 0.76 MAPT (0.55) MAPTLMNAGAAKDM4ETDP1
SCHEMBL7047558 0.76 NOD2 (0.47) MAPTSMN1; SMN2LMNAGAAALDH1A1

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-6291507-B1 INHIBITOR OF MONOCYTE CHEMOATTRACTANT PROTEIN-1; INDOLE DERIVATIVES ASTRAZENECA UK LIMITED (GB) 2001-09-18 US disclosed