SCHEMBL22010799

SCHEMBL22010799

CCCCCOc1cc2oc3cc(CCC)c(F)c(F)c3c2c(F)c1F

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PGAM1 P18669 2/20 0.39
LTB4R Q15722 2/20 0.36
HMGCR P04035 1/20 0.33
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL22011095 0.96 PGAM1 (0.38) PGAM1LTB4RHMGCRKDM4EALDH1A1
SCHEMBL22010784 0.92 ABCB1 (0.34) PGAM1HMGCRKDM4EALDH1A1HPGD
SCHEMBL22011226 0.89 HMGCR (0.36) HMGCRKDM4EALDH1A1HPGDHSD17B10
SCHEMBL22011083 0.88 PGAM1 (0.35) PGAM1LTB4R
SCHEMBL22010810 0.88 PGAM1 (0.35) PGAM1LTB4R
SCHEMBL22010796 0.88 L3MBTL1 (0.35) PGAM1LTB4RALDH1A1
SCHEMBL22010811 0.88 KDM4E (0.36) PGAM1KDM4EALDH1A1HPGDHSD17B10
SCHEMBL22010968 0.87 PGAM1 (0.42) PGAM1LTB4R
SCHEMBL22011181 0.87 PGAM1 (0.42) PGAM1LTB4R
SCHEMBL22010964 0.86 KDM4E (0.37) PGAM1KDM4EALDH1A1HPGDHSD17B10

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-10662378-B2 Compound having fluorodibenzofuran ring, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2020-05-26 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10662378-B2 Compound having fluorodibenzofuran ring, liquid crystal composition and liquid crystal display device YBX1, ZKSCAN2, RCC1 PGAM1 4829/4885LTB4R 1149/4885HMGCR 3852/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.