SCHEMBL7305955

SCHEMBL7305955

CCOC(=O)N1c2ccc(OC)cc2CCC1C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 5/20 0.48
NOTUM Q6P988 1/20 0.45
AGTR2 P50052 1/20 0.43
HSD17B10 Q99714 1/20 0.43
ALDH1A1 P00352 2/20 0.42
LMNA P02545 1/20 0.42
TSHR P16473 1/20 0.42
HTT P42858 1/20 0.42
ACE P12821 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
HTR2C P28335 1/20 0.40
HTR2B P41595 1/20 0.40
NQO2 P16083 3/20 0.40
MTNR1B P49286 3/20 0.40
AKR1B10 O60218 1/20 0.40
AKR1B1 P15121 1/20 0.40

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
SCHEMBL8742789 1.00 MTNR1A (0.48) MTNR1ANOTUMAGTR2HSD17B10ALDH1A1
SCHEMBL8742926 0.89 MTNR1A (0.47) MTNR1ANOTUMHSD17B10ALDH1A1LMNA
SCHEMBL8742853 0.89 MTNR1A (0.47) MTNR1ANOTUMHSD17B10ALDH1A1LMNA
SCHEMBL7316234 0.89 MTNR1A (0.47) MTNR1ANOTUMHSD17B10ALDH1A1LMNA
SCHEMBL7343587 0.86 NOTUM (0.50) MTNR1ANOTUMAGTR2HSD17B10ALDH1A1
SCHEMBL7343593 0.86 NOTUM (0.50) MTNR1ANOTUMAGTR2HSD17B10ALDH1A1
SCHEMBL7307135 0.85 MTNR1A (0.46) MTNR1ANOTUMAGTR2HSD17B10ALDH1A1
SCHEMBL8742995 0.83 NOTUM (0.45) MTNR1ANOTUMHSD17B10ALDH1A1LMNA
SCHEMBL8742991 0.83 NOTUM (0.45) MTNR1ANOTUMHSD17B10ALDH1A1LMNA
SCHEMBL8742962 0.83 NOTUM (0.45) MTNR1ANOTUMHSD17B10ALDH1A1LMNA

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-0699680-B1 Oxazoloquinolinone derivatives, their preparation and their use in therapy SANOFI SYNTHELABO (FR) 2000-03-08 EP claimed
US-5641785-A ANTIDEPRESSANTS, NERVOUS SYSTEM DISORDERS SYNTHELABO (FR) 1997-06-24 US claimed
US-5641785-A ANTIDEPRESSANTS, NERVOUS SYSTEM DISORDERS SYNTHELABO (FR) 1997-06-24 US disclosed