SCHEMBL11294989

SCHEMBL11294989

COC(=O)C(CO)NC(=O)Cc1ccc2cc(OC)ccc2c1C

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.42
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
TAS1R3 Q7RTX0 3/20 0.40
TAS1R1 Q7RTX1 3/20 0.40
MTNR1A P48039 3/20 0.40
MTNR1B P49286 3/20 0.40
RAB9A P51151 1/20 0.39
PTGS1 P23219 1/20 0.39
AKR1C3 P42330 1/20 0.39
AKR1C2 P52895 1/20 0.39
ABCB11 O95342 1/20 0.39
MAPT P10636 1/20 0.39
HTR2C P28335 2/20 0.38

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
SCHEMBL9504259 0.80 KDM4E (0.53) SLC2A1MTNR1AMTNR1BPTGS1AKR1C3
SCHEMBL453836 0.79 AKR1C2 (0.59) SLC2A1MTNR1AMTNR1BPTGS1AKR1C3
SCHEMBL11377119 0.78 MTNR1A (0.47) SLC2A1MTNR1AMTNR1B
SCHEMBL2169014 0.77 PTGS1 (0.47) SLC2A1MTNR1AMTNR1BRAB9APTGS1
SCHEMBL11358172 0.76 MTNR1A (0.50) SLC2A1MTNR1AMTNR1B
SCHEMBL11349550 0.75 MTNR1A (0.49) SLC2A1MTNR1AMTNR1B
SCHEMBL1974909 0.74 HTT (0.61)
SCHEMBL11353686 0.74 SLC2A1 (0.50) SLC2A1MTNR1AMTNR1B
SCHEMBL11350781 0.74 SLC2A1 (0.50) SLC2A1MTNR1AMTNR1B
SCHEMBL17013394 0.74 SLC2A1 (0.46) SLC2A1MEN1KMT2AMTNR1AMTNR1B

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-4362738-A ANTIINFLAMMATORIES DR. KARL THOMAE GMBH (DE) 1982-12-07 US disclosed