SCHEMBL22011088

SCHEMBL22011088

CCCCCOc1cc2oc3cc(OCC4CCC(CCC)CC4)c(F)c(F)c3c2c(F)c1F

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PGAM1 P18669 2/20 0.35
CNR2 P34972 4/20 0.32
HTR2C P28335 4/20 0.31
HTR2A P28223 2/20 0.31
HTR2B P41595 2/20 0.31
PDE4A P27815 2/20 0.31
PDE4D Q08499 2/20 0.31
PDE3B Q13370 2/20 0.31
PDE3A Q14432 2/20 0.31
HTR4 Q13639 1/20 0.31
CNR1 P21554 2/20 0.31
RIPK1 Q13546 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
SCHEMBL22011812 0.94 HTR2C (0.32) CNR2HTR2CHTR2AHTR2BHTR4
SCHEMBL22011196 0.89 CNR2 (0.32) CNR2CNR1RIPK1
SCHEMBL22010982 0.87 CNR2 (0.36) CNR2HTR2CHTR2AHTR2BCNR1
SCHEMBL22011218 0.85 CNR2 (0.32) CNR2CNR1
SCHEMBL22010959 0.85 RIPK1 (0.32) CNR2HTR2CHTR2AHTR2BCNR1
SCHEMBL22010791 0.84 RIPK1 (0.30) RIPK1
SCHEMBL22010822 0.84 PGAM1 (0.33) PGAM1CNR2CNR1
SCHEMBL15445794 0.82 RIPK1 (0.38) CNR2HTR2CHTR2AHTR2BPDE4A
SCHEMBL28697245 0.82 RIPK1 (0.38) CNR2HTR2CHTR2AHTR2BPDE4A
SCHEMBL22011817 0.82 RIPK1 (0.30) RIPK1

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 4829/4885CNR2 1838/4885HTR2C 213/4885

“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.