SCHEMBL9464941

SCHEMBL9464941

CCCCCCCCC=CCCCCCCCC(=O)OCCCCOC1CCCCO1

nearest known ligand 0.67

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
FAAH O00519 1/20 0.45
ALDH1A1 P00352 1/20 0.45
MAPT P10636 1/20 0.45
THRB P10828 1/20 0.45
CNR1 P21554 1/20 0.45
DGKA P23743 1/20 0.44

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
SCHEMBL30028349 1.00 MGLL (0.46) MGLLMEN1KMT2AFAAHALDH1A1
SCHEMBL9464928 1.00 MGLL (0.46) MGLLMEN1KMT2AFAAHALDH1A1
SCHEMBL8920889 0.93 DGKA (0.51) MEN1KMT2ADGKA
SCHEMBL31615051 0.89 PRKCA (0.58) ALDH1A1
SCHEMBL10771687 0.87 MEN1 (0.44) MEN1KMT2AALDH1A1
SCHEMBL11345708 0.87 MEN1 (0.44) MEN1KMT2AALDH1A1
SCHEMBL7597634 0.87 MEN1 (0.44) MEN1KMT2AALDH1A1
SCHEMBL19331817 0.86 MEN1 (0.46) MEN1KMT2AALDH1A1
SCHEMBL31614996 0.86 MEN1 (0.46) MEN1KMT2AALDH1A1
SCHEMBL5595237 0.84 PRKCA (0.55) CNR1DGKA

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
US-5242945-A Antiinflammatory AMERICAN HOME PRODUCTS CORPORATION (US) 1993-09-07 US disclosed
EP-0508690-A1 Tetronic and thiotetronic acid derivatives AMERICAN HOME PRODUCTS CORPORATION (US) 1992-10-14 EP disclosed