SCHEMBL28847934

SCHEMBL28847934

C=CCCC(=O)C(=O)C1=CCCC(C)(C)C1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ FAAH O00519 1/20 0.31

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
SCHEMBL112059 0.85 MEN1 (0.33) MEN1KMT2AFAAH
SCHEMBL11369860 0.79 MEN1 (0.36) MEN1KMT2A
SCHEMBL11374411 0.75 ALDH1A1 (0.31) —
SCHEMBL21837277 0.72 ALDH1A1 (0.37) —
SCHEMBL21837278 0.72 ALDH1A1 (0.37) —
SCHEMBL21189905 0.72 FAAH (0.31) FAAH
SCHEMBL11369889 0.72 CYP3A4 (0.42) MEN1KMT2A
SCHEMBL28347234 0.71 FNTA (0.40) MEN1KMT2A
SCHEMBL11973867 0.71 NPC1 (0.31) FAAH
SCHEMBL29487265 0.71 NPC1 (0.31) FAAH

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
CN-114096235-A Antimicrobial compositions 弗门尼舍有限公司 2022-02-25 — — CN claimed
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