SCHEMBL22011812

SCHEMBL22011812

CCCCCC1CCC(COc2cc3oc4cc(OCC5CCC(CCC)CC5)c(F)c(F)c4c3c(F)c2F)CC1

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 4/20 0.32
HTR2A P28223 2/20 0.32
HTR2B P41595 2/20 0.32
HTR4 Q13639 2/20 0.31
CNR1 P21554 1/20 0.31
CNR2 P34972 1/20 0.31
RIPK1 Q13546 1/20 0.31
CYP1A2 P05177 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
HTT P42858 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
SCHEMBL22011088 0.94 PGAM1 (0.35) HTR2CHTR2AHTR2BHTR4CNR1
SCHEMBL22010982 0.93 CNR2 (0.36) HTR2CHTR2AHTR2BCNR1CNR2
SCHEMBL22010791 0.90 RIPK1 (0.30) RIPK1
SCHEMBL22011196 0.90 CNR2 (0.32) CNR1CNR2RIPK1
SCHEMBL22011218 0.86 CNR2 (0.32) CNR1CNR2
SCHEMBL22010959 0.86 RIPK1 (0.32) HTR2CHTR2AHTR2BCNR1CNR2
SCHEMBL22010834 0.85 CTSL (0.36)
SCHEMBL22011227 0.83
SCHEMBL22011197 0.83
SCHEMBL22011232 0.83 MAPT (0.32) HTR2AMAPT

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 HTR2C 213/4885HTR2A 1052/4885HTR2B 743/4885

“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.