SCHEMBL7265476

SCHEMBL7265476

CNC(=O)CCc1nc(-c2ccccc2)c(-c2ccccc2)[nH]1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.60
NR4A2 P43354 1/20 0.54
HPGD P15428 5/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
LMNA P02545 1/20 0.47
MAPT P10636 1/20 0.47
MTNR1A P48039 1/20 0.46
MTNR1B P49286 1/20 0.46
ALDH1A1 P00352 3/20 0.44
GLA P06280 2/20 0.44
GAA P10253 2/20 0.44
KMT2A Q03164 2/20 0.44
FAAH O00519 1/20 0.44
MAPK13 O15264 1/20 0.43
GCGR P47871 1/20 0.43
MAPK12 P53778 1/20 0.43
MAPK11 Q15759 1/20 0.43
MAPK14 Q16539 1/20 0.43
PTGES O14684 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
SCHEMBL11845098 0.86 KDM4E (0.62) KDM4ENR4A2HPGDSMN1; SMN2LMNA
SCHEMBL7267240 0.84 CHRM1 (0.55) KDM4ENR4A2HPGDSMN1; SMN2LMNA
SCHEMBL2845353 0.84 KDM4E (0.47) KDM4EHPGDSMN1; SMN2LMNAMAPT
SCHEMBL9193870 0.77 RXRA (0.51) KDM4ENR4A2HPGDSMN1; SMN2MAPT
SCHEMBL9518314 0.76 ADORA3 (0.56) KDM4EHPGDSMN1; SMN2LMNAMAPT
SCHEMBL7272062 0.76 KDM4E (0.49) KDM4EHPGDSMN1; SMN2LMNAALDH1A1
SCHEMBL1927942 0.75 KDM4E (0.54) KDM4EHPGDSMN1; SMN2LMNAALDH1A1
Ammonia Solution, Strong SCHEMBL27564581 0.75 ADORA3 (0.55) KDM4EHPGDSMN1; SMN2LMNAMAPT
SCHEMBL11147319 0.75 KDM4E (0.56) KDM4ENR4A2HPGDSMN1; SMN2LMNA
SCHEMBL11839513 0.75 KDM4E (0.55) KDM4EHPGDSMN1; SMN2LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1028991-C Tetrahydronaphthalene derivatives HOFFMANN LA ROCHE (CH) 1995-06-21 CN disclosed
EP-0268148-B1 TETRAHYDRONAPHTHALENE DERIVATIVES AND MEDICAMENTS CONTAINING THEM F. HOFFMANN-LA ROCHE AG (CH) 1991-12-11 EP disclosed
US-4808605-A Tetrahydronaphthalene derivatives as calcium antagonists HOFFMANN-LA ROCHE INC. (US) 1989-02-28 US disclosed
EP-0268148-A1 Tetrahydronaphthalene derivatives and medicaments containing them F. HOFFMANN-LA ROCHE AG (CH) 1988-05-25 EP disclosed
CN-87107875-A TETRAHYDRONAPHTHALENE DERIVATIVES 1988-05-25 CN disclosed