SCHEMBL22010970

SCHEMBL22010970

CCCCCOc1cc2oc3cc(OCC)c(F)c(F)c3c2cc1F

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PGAM1 P18669 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.38
LTB4R Q15722 2/20 0.35
S1PR2 O95136 2/20 0.33
S1PR1 P21453 2/20 0.33
S1PR3 Q99500 2/20 0.33
LPAR2 Q9HBW0 2/20 0.33
THRA P10827 1/20 0.33
THRB P10828 1/20 0.33
FAAH O00519 1/20 0.32
MGLL Q99685 1/20 0.32
CDC25A P30304 1/20 0.31
CDC25B P30305 1/20 0.31
CDC25C P30307 1/20 0.31
TLR8 Q9NR97 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
SCHEMBL29118536 0.95 PGAM1 (0.42) PGAM1L3MBTL1LTB4RS1PR2S1PR1
SCHEMBL22010968 0.88 PGAM1 (0.42) PGAM1L3MBTL1LTB4RS1PR2S1PR1
SCHEMBL22011788 0.83 PGAM1 (0.42) PGAM1L3MBTL1CDC25ACDC25BCDC25C
SCHEMBL22011181 0.82 PGAM1 (0.42) PGAM1L3MBTL1LTB4R
SCHEMBL20828961 0.81 PGAM1 (0.34) PGAM1
SCHEMBL22011194 0.80 MAPT (0.32) PGAM1L3MBTL1
SCHEMBL22010799 0.76 PGAM1 (0.39) PGAM1LTB4R
SCHEMBL22011185 0.76 CAMKK1 (0.39) L3MBTL1
SCHEMBL22010796 0.76 L3MBTL1 (0.35) PGAM1L3MBTL1LTB4RS1PR2S1PR1
SCHEMBL22010811 0.75 KDM4E (0.36) PGAM1

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 4829/4885L3MBTL1 427/4885LTB4R 1149/4885

“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.