SCHEMBL7007385

SCHEMBL7007385

c1cc(C2CC2)c2c3c(ccc2c1)OCCC3

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 4/20 0.47
MTNR1B P49286 3/20 0.47
HTR2C P28335 8/20 0.36
HTR2A P28223 6/20 0.36
HTR1A P08908 6/20 0.36
HTR2B P41595 6/20 0.36
HTR1D P28221 5/20 0.36
HTR6 P50406 2/20 0.34
HTR4 Q13639 2/20 0.34
ADRA2A P08913 2/20 0.34
ADRA2C P18825 2/20 0.34
HTR1B P28222 1/20 0.34
HTR7 P34969 1/20 0.34
ACHE P22303 3/20 0.33
ADRA2B P18089 1/20 0.33
MAP3K14 Q99558 1/20 0.33
SLC9A1 P19634 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32

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
Ammonia Solution, Strong SCHEMBL27534728 0.99 MTNR1A (0.46) MTNR1AMTNR1BHTR2CHTR2AHTR1A
SCHEMBL7009759 0.82 MTNR1B (0.45) MTNR1AMTNR1BHTR2CHTR2AHTR1A
SCHEMBL7228199 0.82 MTNR1B (0.45) MTNR1AMTNR1BHTR2CHTR2AHTR1A
SCHEMBL7237660 0.78 MTNR1B (0.42) MTNR1AMTNR1BHTR2CHTR2AHTR1A
SCHEMBL7237659 0.78 MTNR1B (0.42) MTNR1AMTNR1BHTR2CHTR2AHTR1A
SCHEMBL7016214 0.73 MTNR1A (0.47) MTNR1AMTNR1BHTR2CHTR2AHTR1A
SCHEMBL7012297 0.72 MTNR1A (0.62) MTNR1AMTNR1B
SCHEMBL7012295 0.72 MTNR1A (0.62) MTNR1AMTNR1B
SCHEMBL7357302 0.72 MTNR1A (0.55) MTNR1AMTNR1BHTR2CHTR2AHTR1A
Ammonia Solution, Strong SCHEMBL27497763 0.72 MTNR1A (0.46) MTNR1AMTNR1BHTR2CHTR2AHTR1A

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
EP-0994102-B1 Cyclic derivatives with a cycloalkylenic chain, process for their preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2003-03-19 EP disclosed
EP-0994102-A1 Cyclic derivatives with a cycloalkylenic chain, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 2000-04-19 EP disclosed