SCHEMBL12758189

SCHEMBL12758189

CCCCCCCCCCCCOC(=O)C(C#N)=CC=C1OCC(C)(C)N1C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 8/20 0.48
▸ MEN1 O00255 6/20 0.48
▸ KMT2A Q03164 6/20 0.48
▸ GAA P10253 4/20 0.48
▸ LMNA P02545 3/20 0.48
▸ POLB P06746 1/20 0.48
▸ CYP3A4 P08684 1/20 0.48
▸ CYP2D6 P10635 1/20 0.48
▸ CYP2C9 P11712 1/20 0.48
▸ CYP2C19 P33261 1/20 0.48
▸ RAB9A P51151 4/20 0.42
▸ NPC1 O15118 3/20 0.42
▸ USP2 O75604 3/20 0.42
▸ SMN1; SMN2 Q16637 3/20 0.42
▸ NPSR1 Q6W5P4 3/20 0.42
▸ TP53 P04637 2/20 0.38
▸ ALDH1A1 P00352 4/20 0.38
▸ KDM4E B2RXH2 3/20 0.37
▸ THRB P10828 1/20 0.37
▸ HPGD P15428 1/20 0.37

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
SCHEMBL17445954 0.87 MAPT (0.55) MAPTMEN1KMT2AGAALMNA
SCHEMBL26338686 0.81 MEN1 (0.47) MAPTMEN1KMT2AGAALMNA
SCHEMBL17445953 0.78 GLO1 (0.35) MAPTMEN1KMT2AGAALMNA
SCHEMBL12758187 0.77 LMNA (0.35) MAPTLMNAPOLBCYP3A4SMN1; SMN2
SCHEMBL12260850 0.73 PRKCA (0.36) GAALMNAALDH1A1PRKCATSHR
SCHEMBL8000911 0.71 TSHR (0.53) MAPTMEN1KMT2AGAALMNA
SCHEMBL9240543 0.70 TSHR (0.50) MAPTMEN1KMT2AGAALMNA
SCHEMBL9240541 0.70 TSHR (0.50) MAPTMEN1KMT2AGAALMNA
SCHEMBL14518010 0.69 TSHR (0.50) MAPTMEN1KMT2AGAALMNA
SCHEMBL13992591 0.69 TSHR (0.50) MAPTMEN1KMT2AGAALMNA

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-20110057155-A1 ULTRAVIOLET ABSORBENT COMPOSITION FUJIFILM CORPORATION (JP) 2011-03-10 — — US disclosed
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