SCHEMBL22011006

SCHEMBL22011006

CCCCCC1CCC(c2ccc(-c3cc4oc5cc(C6CCC(CCC)CC6)c(F)c(F)c5c4c(F)c3F)cc2)CC1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.37
MAPT P10636 2/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
MEN1 O00255 1/20 0.35
MAPK1 P28482 1/20 0.35
KMT2A Q03164 1/20 0.35
GAA P10253 1/20 0.33
ESR2 Q92731 1/20 0.31
SPHK1 Q9NYA1 1/20 0.31
CYP3A4 P08684 1/20 0.30
CYP2C8 P10632 1/20 0.30
S1PR3 Q99500 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
SCHEMBL22010838 0.87 RARB (0.35) SPHK1
SCHEMBL22011219 0.86 SPHK1 (0.46) CYP2C9MAPTALDH1A1LMNAMEN1
SCHEMBL22011811 0.85 CYP3A4 (0.32) CYP2C9MAPTGAACYP3A4CYP2C8
SCHEMBL22010986 0.85 MAPT (0.33) CYP2C9MAPTALDH1A1LMNAMEN1
SCHEMBL22010997 0.85 MAPT (0.33) MAPTMEN1KMT2AGAA
SCHEMBL22011221 0.80 SPHK1 (0.34) MAPTSPHK1
SCHEMBL22011215 0.79 CYP2C9 (0.36) CYP2C9MAPTALDH1A1LMNAMEN1
SCHEMBL22010813 0.79 MAPT (0.32) MAPTMEN1KMT2AGAA
SCHEMBL22010971 0.79
SCHEMBL22011232 0.78 MAPT (0.32) MAPTMEN1KMT2AGAA

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 CYP2C9 1213/4885MAPT 1234/4885ALDH1A1 577/4885

“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.