SCHEMBL8374249

SCHEMBL8374249

Oc1cccc2c1SCCO2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 4/20 0.46
MTNR1B P49286 1/20 0.42
ITGB2 P05107 1/20 0.38
ICAM1 P05362 1/20 0.38
ITGAL P20701 1/20 0.38
SMN1; SMN2 Q16637 4/20 0.34
LMNA P02545 3/20 0.34
CRHBP P24387 2/20 0.34
CRHR2 Q13324 2/20 0.34
HTT P42858 1/20 0.34
CTNNB1 P35222 3/20 0.34
WNT3A P56704 3/20 0.34
RAB9A P51151 3/20 0.33
GAA P10253 2/20 0.33
MAPT P10636 2/20 0.33
MAP3K14 Q99558 1/20 0.33
HSD17B10 Q99714 2/20 0.31
ADAMTS4 O75173 1/20 0.31
ALDH1A1 P00352 1/20 0.31
EGFR P00533 1/20 0.31

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
SCHEMBL8291502 0.77 MTNR1A (0.46) MTNR1AMTNR1BITGB2ICAM1ITGAL
SCHEMBL6582231 0.77 MTNR1A (0.43) MTNR1AMTNR1BITGB2ICAM1ITGAL
SCHEMBL8481752 0.75 MTNR1A (0.48) MTNR1AMTNR1BSMN1; SMN2CTNNB1WNT3A
SCHEMBL29565464 0.73 CTNNB1 (0.41) MTNR1AMTNR1BITGB2ICAM1ITGAL
SCHEMBL25707671 0.73 MTNR1A (0.43) MTNR1AMTNR1BITGB2ICAM1ITGAL
SCHEMBL29262317 0.73 CTNNB1 (0.41) MTNR1AMTNR1BITGB2ICAM1ITGAL
SCHEMBL7522473 0.72 MTNR1A (0.64) MTNR1AMTNR1BITGB2ICAM1ITGAL
SCHEMBL6582388 0.72 MTNR1A (0.48) MTNR1AMTNR1BSMN1; SMN2CTNNB1WNT3A
SCHEMBL6583525 0.71 MTNR1A (0.50) MTNR1AMTNR1BSMN1; SMN2LMNAHTT
SCHEMBL997534 0.71 MTNR1A (0.44) MTNR1AMTNR1BSMN1; SMN2CTNNB1WNT3A

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-0671397-B1 Alkylaminoindane compounds, processes for their preparation and pharmaceutical compositions containing them ADIR (FR) 1999-02-03 EP disclosed
US-5569669-A Alkylaminoindane compounds ADIR ET COMPAGNIE (FR) 1996-10-29 US disclosed
EP-0671397-A1 Alkylaminoindanes compounds, processes for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1995-09-13 EP disclosed