SCHEMBL3154123

SCHEMBL3154123

CCCCCCCc1ccc(-c2ccc3c(F)c(OC(F)(F)F)c(F)cc3c2)c(F)c1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RARB P10826 4/20 0.43
RARA P10276 1/20 0.36
RARG P13631 1/20 0.36
FAAH O00519 2/20 0.34
PTGS2 P35354 1/20 0.34
GPR3 P46089 1/20 0.33
HTR2A P28223 1/20 0.32
RORA P35398 1/20 0.32
RORC P51449 1/20 0.32
NR1H4 Q96RI1 1/20 0.32
DHODH Q02127 1/20 0.32
SPNS2 Q8IVW8 2/20 0.32
S1PR1 P21453 1/20 0.32
GRM2 Q14416 1/20 0.32
ALOX5AP P20292 1/20 0.31
FEN1 P39748 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
SCHEMBL3152886 0.99 RARB (0.42) RARBRARARARGFAAHPTGS2
SCHEMBL3160890 0.95 RARB (0.43) RARBRARARARGGPR3RORA
SCHEMBL3162066 0.93 RARB (0.43) RARBRARARARGFAAHS1PR1
SCHEMBL3162320 0.92 RARB (0.39) RARBRARARARGRORCS1PR1
SCHEMBL3163256 0.91 ALOX5AP (0.33) RARBGRM2ALOX5APFEN1
SCHEMBL3158642 0.90 RARB (0.39) RARBRARARARGS1PR1ALOX5AP
SCHEMBL3158048 0.89 RARB (0.46) RARBRARARARGFAAHPTGS2
SCHEMBL3168596 0.88 RARB (0.36) RARBRARARARGFAAHPTGS2
SCHEMBL3154328 0.88 RARB (0.44) RARBRARARARGFAAHHTR2A
SCHEMBL3157715 0.88 RARB (0.44) RARBRARARARGFAAHHTR2A

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 RARB 4021/4885RARA 3552/4885RARG 3792/4885

“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.