SCHEMBL8935162

SCHEMBL8935162

C=CCOc1ccc(-c2ccc(-c3ccc(C4CCC(CCCC)CC4)c(F)c3F)cc2)c(F)c1F

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 9/20 0.35
HTR2A P28223 5/20 0.35
HTR2B P41595 4/20 0.34
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
CYP2D6 P10635 1/20 0.32
KMT2A Q03164 1/20 0.32
ALOX5AP P20292 1/20 0.31
FEN1 P39748 1/20 0.31
LMNA P02545 1/20 0.31
GABRA1 P14867 1/20 0.30
GABRB2 P47870 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
SCHEMBL8962413 0.97 HTR2C (0.33) HTR2CHTR2AHTR2BMEN1ALDH1A1
SCHEMBL8935430 0.96 HTR2C (0.34) HTR2CHTR2AHTR2BMEN1ALDH1A1
SCHEMBL8935665 0.96 HTR2C (0.34) HTR2CHTR2AHTR2BMEN1ALDH1A1
SCHEMBL8935564 0.96 HTR2C (0.34) HTR2CHTR2AHTR2BMEN1ALDH1A1
SCHEMBL19985603 0.95 HTR2C (0.36) HTR2CHTR2AHTR2BMEN1ALDH1A1
SCHEMBL8963378 0.93 HTR2C (0.32) HTR2CHTR2AHTR2B
SCHEMBL8962924 0.93 HTR2C (0.32) HTR2CHTR2AHTR2B
SCHEMBL8962834 0.93 HTR2C (0.32) HTR2CHTR2AHTR2B
SCHEMBL19985605 0.92 HTR2C (0.36) HTR2CHTR2AHTR2BMEN1ALDH1A1
SCHEMBL19985430 0.91 HTR2C (0.35) HTR2CHTR2AHTR2BMEN1ALDH1A1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8187494-B2 Four- or five-ring liquid crystal compound having lateral fluorine, liquid crystal composition, and liquid crystal display device JNC CORPORATION (JP) 2012-05-29 US disclosed
US-8187494-B2 Four- or five-ring liquid crystal compound having lateral fluorine, liquid crystal composition, and liquid crystal display device JNC CORPORATION (JP) 2012-05-29 US disclosed
US-20100309402-A1 FOUR- OR FIVE-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE CHISSO CORPORATION (JP) 2010-12-09 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-20100309402-A1 FOUR- OR FIVE-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE KIF23, HCN3, FZD7 HTR2C 447/4885HTR2A 1638/4885HTR2B 1261/4885

“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.