SCHEMBL6060072

SCHEMBL6060072

C=CCCc1ccc2c(F)c(-c3cc(F)c(-c4cc(F)c(-c5ccccc5C(F)(F)F)c(F)c4)c(F)c3)ccc2c1

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 2/20 0.35
HSD11B1 P28845 1/20 0.35
FFAR1 O14842 1/20 0.34
ALOX5AP P20292 1/20 0.32
FEN1 P39748 1/20 0.32

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
SCHEMBL6059358 0.94 ALOX5AP (0.37) TRPA1HSD11B1FFAR1ALOX5APFEN1
SCHEMBL3159341 0.93 HSD11B1 (0.34) TRPA1HSD11B1FFAR1ALOX5APFEN1
SCHEMBL6059615 0.92 TRPA1 (0.36) TRPA1HSD11B1FFAR1ALOX5APFEN1
SCHEMBL3165522 0.89 CYP11B2 (0.38) HSD11B1ALOX5APFEN1
SCHEMBL3173126 0.88
SCHEMBL6059559 0.87 ALOX5AP (0.39) TRPA1HSD11B1FFAR1ALOX5APFEN1
SCHEMBL3152860 0.86 ALOX5AP (0.36) TRPA1HSD11B1FFAR1ALOX5APFEN1
SCHEMBL6059593 0.86 FFAR1 (0.36) TRPA1HSD11B1FFAR1ALOX5APFEN1
SCHEMBL3168247 0.85
SCHEMBL6059619 0.85 KIF11 (0.42)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7145047-B2 Naphthalene derivative and liquid crystal composition comprising the same DAINIPPON INK AND CHEMICALS, INC. (JP) 2006-12-05 US disclosed
EP-1452514-A1 Naphthalene derivative and liquid crystal composition comprising the same DAINIPPON INK AND CHEMICALS, INC. (JP) 2004-09-01 EP disclosed
US-20030136944-A1 Naphthalene derivative and liquid crystal composition comprising the same DAINIPPON INK AND CHEMICALS, INC. (JP) 2003-07-24 US disclosed
EP-1273562-A1 Naphthalene derivative and liquid crystal composition comprising the same DAINIPPON INK AND CHEMICALS, INC. (JP) 2003-01-08 EP disclosed
US-6468607-B1 MISCIBILITY, LARGE BIREFRINGENCE INDEX, NO STRONGLY POLAR GROUP IN ITS MOLECULE AND THUS CAN ALSO BE USED FOR ACTIVE MATRIX DRIVING, WIDE TEMPERATURE RANGE AND REQUIRES A HIGH SPEED RESPONSE AND A LOW VOLTAGE DRIVING DAINIPPON INK AND CHEMICALS, INC. (JP) 2002-10-22 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-20030136944-A1 Naphthalene derivative and liquid crystal composition comprising the same NLK, NOTCH1, NOTCH4 TRPA1 87/4885HSD11B1 937/4885FFAR1 4057/4885

“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.