Sugi Predict

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SCHEMBL22016853

SCHEMBL22016853

Cc1cc(C2=CCC(c3ccc(OCC(C)O)cc3)CC2)ccc1OCC(C)O

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MCHR1 Q99705 15/20 0.39
▸ LMNA P02545 2/20 0.35
▸ FFAR4 Q5NUL3 1/20 0.32
▸ SMN1; SMN2 Q16637 2/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ POLB P06746 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
SCHEMBL22621331 0.94 MCHR1 (0.36) MCHR1LMNA
SCHEMBL22911556 0.92 MCHR1 (0.35) MCHR1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL13948791 0.89 MCHR1 (0.41) MCHR1LMNASMN1; SMN2POLB
SCHEMBL2720921 0.84 MCHR1 (0.39) MCHR1
SCHEMBL2718333 0.82 TLR8 (0.39) MCHR1
SCHEMBL2721199 0.82 MCHR1 (0.32) MCHR1
SCHEMBL2720167 0.82 MCHR1 (0.32) MCHR1
SCHEMBL13948793 0.81 MCHR1 (0.37) MCHR1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL13412094 0.81 MCHR1 (0.34) MCHR1LMNAFFAR4SMN1; SMN2MEN1
SCHEMBL2718811 0.81 TLR8 (0.42) MCHR1

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-3653660-A1 THERMALLY CONDUCTIVE MATERIAL, DEVICE PROVIDED WITH THERMALLY CONDUCTIVE LAYER, THERMALLY CONDUCTIVE MATERIAL FORMATION COMPOSITION, DISC-SHAPED LIQUID CRYSTAL COMPOUND FUJIFILM Corporation (JP) 2020-05-20 — — EP disclosed