SCHEMBL18699228

SCHEMBL18699228

C/C=C/C(=O)N(CC)C(C)C

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 2/20 0.39
▸ LMNA P02545 1/20 0.39
▸ CHRNB2 P17787 1/20 0.31
▸ CHRNB4 P30926 1/20 0.31
▸ CHRNA3 P32297 1/20 0.31
▸ CHRNA4 P43681 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.30

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
SCHEMBL22053010 0.83 CYP3A4 (0.40) CYP3A4LMNA
SCHEMBL17666081 0.79 ALDH1A1 (0.31) CYP3A4LMNAALDH1A1
SCHEMBL17666078 0.79 ALDH1A1 (0.31) CYP3A4LMNAALDH1A1
SCHEMBL25468424 0.78 — —
SCHEMBL11445630 0.77 CYP3A4 (0.35) CYP3A4LMNACHRNB2CHRNB4CHRNA3
SCHEMBL11469132 0.77 CYP3A4 (0.35) CYP3A4LMNACHRNB2CHRNB4CHRNA3
SCHEMBL26773201 0.76 CA12 (0.39) CYP3A4LMNAALDH1A1
SCHEMBL460923 0.76 TSHR (0.42) ALDH1A1
SCHEMBL2654047 0.76 — —
Crotetamide SCHEMBL26015 0.74 CYP3A4 (0.33) CYP3A4LMNA

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-9612532-B2 Photosensitive coloring composition, color filter, method for producing color filter, organic el liquid crystal display device, and color filter forming kit FUJIFILM CORPORATION (JP) 2017-04-04 — — US disclosed
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