SCHEMBL3153382

SCHEMBL3153382

CCC[C@H]1CC[C@H](CCc2ccc3c(F)c(-c4ccc(OC(F)(F)F)c(F)c4)ccc3c2)CC1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 1/20 0.33
ALOX5AP P20292 1/20 0.32
FEN1 P39748 1/20 0.32
GRM2 Q14416 4/20 0.32
CTSK P43235 1/20 0.32
NAAA Q02083 1/20 0.32
HCRTR1 O43613 4/20 0.32
HCRTR2 O43614 4/20 0.32
KCNH2 Q12809 1/20 0.32
NCEH1 Q6PIU2 1/20 0.31
EPHX2 P34913 2/20 0.31
P2RX7 Q99572 1/20 0.31
PDE2A O00408 1/20 0.31

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
SCHEMBL3153390 1.00 FFAR4 (0.33) FFAR4ALOX5APFEN1GRM2CTSK
SCHEMBL3172023 0.94 FFAR4 (0.32) FFAR4ALOX5APFEN1GRM2CTSK
SCHEMBL3172014 0.94 FFAR4 (0.32) FFAR4ALOX5APFEN1GRM2CTSK
SCHEMBL3172545 0.94 FFAR4 (0.33) FFAR4ALOX5APFEN1GRM2CTSK
SCHEMBL3961887 0.94 FFAR4 (0.33) FFAR4ALOX5APFEN1GRM2CTSK
SCHEMBL3166699 0.94 FFAR4 (0.31) FFAR4ALOX5APFEN1GRM2CTSK
SCHEMBL3166714 0.94 FFAR4 (0.31) FFAR4ALOX5APFEN1GRM2CTSK
SCHEMBL3153067 0.93 CNR1 (0.31) FFAR4ALOX5APFEN1GRM2CTSK
SCHEMBL6059976 0.93 CNR1 (0.31) FFAR4ALOX5APFEN1GRM2CTSK
SCHEMBL3153200 0.93 CNR1 (0.31) FFAR4ALOX5APFEN1GRM2CTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1452514-B1 Naphthalene derivative and liquid crystal composition comprising the same DAINIPPON INK & CHEMICALS (JP) 2010-03-31 EP disclosed
EP-1273562-B1 Naphthalene derivative and liquid crystal composition comprising the same DAINIPPON INK & CHEMICALS (JP) 2009-07-22 EP disclosed
US-7145047-B2 Naphthalene derivative and liquid crystal composition comprising the same DAINIPPON INK AND CHEMICALS, INC. (JP) 2006-12-05 US disclosed
EP-0952135-B1 Naphthalene derivative and liquid crystal composition comprising the same DAINIPPON INK & CHEMICALS (JP) 2005-01-05 EP 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
EP-0952135-A1 Naphthalene derivative and liquid crystal composition comprising the same DAINIPPON INK AND CHEMICALS, INC. (JP) 1999-10-27 EP 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 FFAR4 3795/4885ALOX5AP 1638/4885FEN1 3373/4885

“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.