SCHEMBL18724249

SCHEMBL18724249

Cc1ccc(C2Oc3ccccc3N2C)c(C)c1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.39
▸ HTR1A P08908 4/20 0.35
▸ HTR3A P46098 4/20 0.35
▸ GSK3B P49841 1/20 0.33
▸ HTR2A P28223 1/20 0.33
▸ HTR2C P28335 1/20 0.33
▸ HRH1 P35367 1/20 0.33
▸ PBRM1 Q86U86 1/20 0.33
▸ SLC6A2 P23975 1/20 0.33
▸ SLC6A4 P31645 1/20 0.33
▸ SLC6A3 Q01959 1/20 0.33
▸ NPSR1 Q6W5P4 2/20 0.33
▸ TSHR P16473 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ ALDH2 P05091 1/20 0.32
▸ P2RX4 Q99571 1/20 0.32
▸ HTT P42858 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
SCHEMBL18674333 0.75 LMNA (0.49) LMNAHTR1AHTR3ASLC6A2SLC6A4
SCHEMBL7537968 0.71 ADK (0.38) LMNAHTR1AGSK3BALDH1A1HTT
SCHEMBL11886348 0.67 KDM4E (0.46) GSK3BNPSR1TSHRALDH1A1
SCHEMBL21972241 0.67 LMNA (0.41) LMNAHTR3ASLC6A2SLC6A4SLC6A3
SCHEMBL11689786 0.66 ACHE (0.43) LMNAPBRM1ALDH1A1
SCHEMBL30701084 0.65 CYP1A2 (0.39) LMNAGSK3BTSHRALDH1A1
SCHEMBL20027221 0.64 GPR3 (0.39) TSHRALDH1A1P2RX4HTT
SCHEMBL16728888 0.64 GPR3 (0.39) TSHRALDH1A1P2RX4HTT
SCHEMBL11044842 0.64 MAOB (0.40) HTR1A
SCHEMBL13023294 0.64 P2RX4 (0.45) NPSR1ALDH1A1P2RX4HTT

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
EP-3153501-A1 GLUCAGON ANTAGONISTS Metabasis Therapeutics, Inc. (US) 2017-04-12 — — EP disclosed
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