SCHEMBL11853803

SCHEMBL11853803

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

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ GRIK1 P39086 1/20 0.32
▸ GRIK2 Q13002 1/20 0.32
▸ FNTA P49354 1/20 0.32
▸ FNTB P49356 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ ATM Q13315 1/20 0.32
▸ ALOX15 P16050 1/20 0.31
▸ CHRNB2 P17787 1/20 0.30
▸ CHRNB4 P30926 1/20 0.30
▸ CHRNA3 P32297 1/20 0.30
▸ CHRNA4 P43681 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
SCHEMBL11853807 1.00 ALDH1A1 (0.39) ALDH1A1LMNACYP3A4TDP1GRIK1
SCHEMBL11867205 0.88 KDM4E (0.42) ALDH1A1LMNACYP3A4TDP1GRIK1
SCHEMBL11867208 0.88 KDM4E (0.42) ALDH1A1LMNACYP3A4TDP1GRIK1
SCHEMBL11870021 0.85 GRIK1 (0.35) ALDH1A1LMNACYP3A4TDP1GRIK1
SCHEMBL11870019 0.85 GRIK1 (0.35) ALDH1A1LMNACYP3A4TDP1GRIK1
SCHEMBL11861076 0.85 ALDH1A1 (0.36) ALDH1A1LMNACYP3A4TDP1
SCHEMBL11861082 0.85 ALDH1A1 (0.36) ALDH1A1LMNACYP3A4TDP1
SCHEMBL11857972 0.85 ALDH1A1 (0.36) ALDH1A1LMNACYP3A4TDP1
SCHEMBL11857980 0.85 ALDH1A1 (0.36) ALDH1A1LMNACYP3A4TDP1
SCHEMBL11850606 0.85 ALOX15 (0.45) ALDH1A1LMNACYP3A4TDP1FNTA

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-3940444-A Novel keto-ethers ZOECON CORPORATION (US) 1976-02-24 — — US disclosed
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