SCHEMBL7267151

SCHEMBL7267151

CNCCCCCCn1c(=O)[nH]c2ccncc21

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DAO P14920 1/20 0.47
MAPT P10636 2/20 0.40
TSHR P16473 2/20 0.40
MAPK1 P28482 2/20 0.40
HTT P42858 2/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
HPGD P15428 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
HTR7 P34969 5/20 0.39
RAB9A P51151 1/20 0.38
POLB P06746 1/20 0.38
RECQL P46063 1/20 0.37
P2RX7 Q99572 1/20 0.37
PGR P06401 1/20 0.37

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
SCHEMBL7267288 0.81 LMNA (0.61) MAPTTSHRMAPK1HTTALDH1A1
SCHEMBL7275269 0.80 LMNA (0.62) MAPTTSHRMAPK1HTTALDH1A1
SCHEMBL891430 0.76 DAO (0.55) DAOMAPTTSHRMAPK1HTT
SCHEMBL2270268 0.76 CYP1A2 (0.60) DAOTSHRLMNASMN1; SMN2RAB9A
SCHEMBL738662 0.76 DAO (0.51) DAOMAPTTSHRMAPK1HTT
SCHEMBL3286243 0.71 DAO (0.69) DAOLMNAPGR
SCHEMBL891476 0.69 MEN1 (0.63) MAPTTSHRMAPK1HTTALDH1A1
SCHEMBL2173962 0.68 DAO (0.49) DAO
SCHEMBL2482082 0.68 NAAA (0.46) DAOLMNASMN1; SMN2
SCHEMBL8247664 0.68 ADORA3 (0.51) DAOMAPTTSHRMAPK1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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