SCHEMBL6976443

SCHEMBL6976443

CCOC(=O)c1cnc(Cc2ccc(Cl)cc2)[nH]1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.51
MAPT P10636 5/20 0.51
NPC1 O15118 1/20 0.51
TP53 P04637 1/20 0.51
RAB9A P51151 1/20 0.51
NPSR1 Q6W5P4 3/20 0.50
ALDH1A1 P00352 3/20 0.50
KDM4E B2RXH2 2/20 0.50
KMT2A Q03164 1/20 0.50
KCNH2 Q12809 1/20 0.50
RXFP1 Q9HBX9 1/20 0.50
TNF P01375 1/20 0.50
HSP90AA1 P07900 1/20 0.50
HPGD P15428 1/20 0.50
ALOX12 P18054 1/20 0.50
CCR6 P51684 1/20 0.50
RUNX1 Q01196 1/20 0.50
CBFB Q13951 1/20 0.50
HKDC1 Q2TB90 1/20 0.50
NOD2 Q9HC29 1/20 0.50

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
SCHEMBL31043471 0.86 MEN1 (0.50) LMNAMAPTNPC1TP53RAB9A
SCHEMBL19207667 0.86 MMP2 (0.59) LMNAMAPTNPC1RAB9ANPSR1
SCHEMBL19779975 0.82 ALOX15 (0.46) ALOX15
SCHEMBL4604916 0.80 ALPL (0.56) LMNAMAPTNPC1TP53RAB9A
SCHEMBL22272868 0.79 LMNA (0.54) LMNAMAPTNPC1TP53RAB9A
SCHEMBL18626491 0.76 ALOX15 (0.47) LMNAMAPTNPC1TP53RAB9A
SCHEMBL17610937 0.75 NPC1 (0.47) LMNAMAPTNPC1RAB9AALDH1A1
SCHEMBL20897262 0.75 ALPL (0.64) LMNAMAPTNPC1TP53RAB9A
SCHEMBL27454468 0.74 MMP2 (0.48) LMNAMAPTNPC1RAB9AALDH1A1
SCHEMBL12857949 0.74 MAPT (0.59) LMNAMAPTNPC1TP53RAB9A

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
US-6566376-B1 For therapy of chemokine receptor related diseases and conditions such as rheumatoid arthritis, chronic obstructive pulmonary disease ASTRAZENECA UK LIMITED (GB) 2003-05-20 US disclosed
EP-1202984-B1 DIPHENYL-PIPERIDINE DERIVATE ASTRAZENECA UK LTD (GB) 2003-03-05 EP disclosed