SCHEMBL21085336

SCHEMBL21085336

O=C(CCl)[C@@H]1CCCC1C1CCCC1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PEPD P12955 1/20 0.33
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
NPC1 O15118 1/20 0.30
MITF O75030 1/20 0.30
ALDH1A1 P00352 1/20 0.30
RAB9A P51151 1/20 0.30
KMT2A Q03164 1/20 0.30
PAX8 Q06710 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL8545394 0.92 POLB (0.32)
SCHEMBL29107850 0.78 HSD11B1 (0.33) PEPD
SCHEMBL10709879 0.77 HSD11B1 (0.31) ALDH1A1
SCHEMBL298970 0.76 HSD11B1 (0.33) PEPDALDH1A1
SCHEMBL20043804 0.75 HSD11B1 (0.34)
SCHEMBL29107599 0.74 CYP1A2 (0.32)
SCHEMBL4766405 0.74 PEPD (0.42) PEPDKDM4EMEN1ALDH1A1KMT2A
SCHEMBL18532463 0.74 PEPD (0.42) PEPDKDM4EMEN1ALDH1A1KMT2A
SCHEMBL7734513 0.74 PEPD (0.42) PEPDKDM4EMEN1ALDH1A1KMT2A
SCHEMBL195046 0.74 PEPD (0.42) PEPDKDM4EMEN1ALDH1A1KMT2A

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-10910634-B2 Electroactive ionic liquids and surface-modified substrates containing them UNIVERSITÉ PARIS CITÉ (FR) 2021-02-02 US disclosed
US-20190173078-A1 Electroactive Ionic Liquids And Surface-Modified Substrates Containing Them CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2019-06-06 US disclosed