SCHEMBL23214817

SCHEMBL23214817

CCCOC(=O)C(CCC)(CCC)CCC.[AlH3]

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.38
CYP4F2 P78329 2/20 0.37
CYP4A11 Q02928 2/20 0.37
LMNA P02545 4/20 0.36
ALDH1A1 P00352 4/20 0.36
HSD17B10 Q99714 2/20 0.36
SCN1A P35498 3/20 0.35
SCN2A Q99250 3/20 0.35
SCN3A Q9NY46 3/20 0.35
TSHR P16473 2/20 0.35
CYP1A2 P05177 2/20 0.35
CYP3A4 P08684 2/20 0.35
CYP2D6 P10635 2/20 0.35
CYP2C9 P11712 2/20 0.35
CYP2C19 P33261 2/20 0.35
NFKB1 P19838 1/20 0.35
MTOR P42345 1/20 0.35
RAB9A P51151 1/20 0.35
SIGMAR1 Q99720 1/20 0.35
ESR1 P03372 1/20 0.34

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
SCHEMBL27855281 0.98 HCAR2 (0.39) HCAR2CYP4F2CYP4A11LMNAALDH1A1
Ammonia Solution, Strong SCHEMBL467204 0.95 HCAR2 (0.38) HCAR2CYP4F2CYP4A11LMNAALDH1A1
Acetic Acid SCHEMBL11489928 0.91 HCAR2 (0.39) HCAR2CYP4F2CYP4A11LMNAALDH1A1
SCHEMBL17617119 0.89 CYP4F2 (0.48) HCAR2CYP4F2CYP4A11LMNAALDH1A1
Ammonia Solution, Strong SCHEMBL28085859 0.88 CYP4F2 (0.41) HCAR2CYP4F2CYP4A11LMNAALDH1A1
Ammonia Solution, Strong SCHEMBL28139804 0.85 CYP4F2 (0.42) CYP4F2CYP4A11TSHRMEN1KMT2A
SCHEMBL27972195 0.85 CYP4F2 (0.32) HCAR2CYP4F2CYP4A11LMNAALDH1A1
SCHEMBL9474447 0.85 CYP4F2 (0.39) HCAR2CYP4F2CYP4A11LMNAALDH1A1
SCHEMBL28139336 0.84 NAAA (0.34) HCAR2CYP4F2CYP4A11LMNAALDH1A1
SCHEMBL2687299 0.83 GRM4 (0.37) HCAR2CYP4F2CYP4A11LMNAALDH1A1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220066347-A1 LIQUID ELECTROPHOTOGRAPHIC INK COMPOSITIONS HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. (US) 2022-03-03 US disclosed
EP-3914657-A1 LIQUID ELECTROPHOTOGRAPHIC INK COMPOSITIONS Hewlett-Packard Development Company, L.P. (US) 2021-12-01 EP disclosed
WO-2021071504-A1 LIQUID ELECTROPHOTOGRAPHIC INK COMPOSITIONS HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. (US) 2021-04-15 WO disclosed