SCHEMBL10684249

SCHEMBL10684249

c1ccc(CC2CCc3ccccc3N2)cc1

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 3/20 0.50
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
POLB P06746 1/20 0.45
GRIN2B Q13224 3/20 0.43
SLC22A1 O15245 1/20 0.41
PRCP P42785 1/20 0.41
GBA1 P04062 1/20 0.41

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
SCHEMBL17634157 0.87 MTNR1A (0.46) MTNR1AMEN1KMT2A
SCHEMBL16062271 0.85 MTNR1A (0.51) MTNR1AMEN1KMT2A
SCHEMBL4138679 0.83 MTNR1A (0.48) MTNR1AGRIN2B
SCHEMBL12049299 0.82 MEN1 (0.51) MEN1KMT2APOLBGRIN2BSLC22A1
SCHEMBL7951734 0.82 MTNR1A (0.55) MTNR1A
SCHEMBL28765711 0.82 MTNR1A (0.44) MTNR1AMEN1KMT2A
SCHEMBL19260263 0.79 MTNR1A (0.51) MTNR1A
SCHEMBL4139663 0.79 MTNR1A (0.60) MTNR1A
SCHEMBL700861 0.79 MTNR1A (0.56) MTNR1AGBA1
SCHEMBL7149457 0.79 MTNR1A (0.56) MTNR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4738972-A Hypoglycemic thiazolidinediones PFIZER INC. (US) 1988-04-19 US disclosed