SCHEMBL27117352

SCHEMBL27117352

CCC(CC)COC(=O)/C(C#N)=C/C=C1\CCCN1C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 12/20 0.42
▸ MEN1 O00255 8/20 0.42
▸ KMT2A Q03164 8/20 0.42
▸ RAB9A P51151 7/20 0.42
▸ NPC1 O15118 6/20 0.42
▸ GAA P10253 4/20 0.42
▸ SMN1; SMN2 Q16637 4/20 0.42
▸ USP2 O75604 3/20 0.42
▸ NPSR1 Q6W5P4 3/20 0.42
▸ ALDH1A1 P00352 11/20 0.40
▸ LMNA P02545 4/20 0.40
▸ CYP2C9 P11712 2/20 0.38
▸ POLB P06746 2/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ CYP2D6 P10635 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ KDM4E B2RXH2 4/20 0.37
▸ HPGD P15428 2/20 0.37
▸ TP53 P04637 1/20 0.37
▸ THRB P10828 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
SCHEMBL19038950 0.92 ALDH1A1 (0.44) MAPTMEN1KMT2ARAB9ANPC1
SCHEMBL19038917 0.87 MAPT (0.55) MAPTMEN1KMT2ARAB9ANPC1
SCHEMBL22484311 0.87 MAPT (0.44) MAPTMEN1KMT2ARAB9ANPC1
SCHEMBL26338677 0.82 MEN1 (0.34) MAPTMEN1KMT2ARAB9ANPC1
SCHEMBL19038893 0.82 MAPT (0.45) MAPTMEN1KMT2ARAB9ANPC1
SCHEMBL19051318 0.80 MAPT (0.40) MAPTMEN1KMT2ARAB9ANPC1
SCHEMBL24390209 0.80 MAPT (0.40) MAPTMEN1KMT2ARAB9ANPC1
SCHEMBL19051259 0.79 APP (0.46) MAPTMEN1KMT2ARAB9ANPC1
SCHEMBL23609195 0.79 MAPT (0.39) MAPTMEN1KMT2ARAB9ANPC1
SCHEMBL22477554 0.78 MAPT (0.38) MAPTMEN1KMT2ARAB9ANPC1

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-20240067846-A1 PHOTOPOLYMERIZABLE COMPOSITION, CURED SUBSTANCE, AND OPTICAL MEMBER FUJIFILM CORPORATION (JP) 2024-02-29 — — US disclosed
US-20240067846-A1 PHOTOPOLYMERIZABLE COMPOSITION, CURED SUBSTANCE, AND OPTICAL MEMBER FUJIFILM CORPORATION (JP) 2024-02-29 — — US disclosed
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