SCHEMBL12622909

SCHEMBL12622909

CCCCCc1ccc(-c2ccc(-c3cc(F)c(-c4cc(F)cc(F)c4)c(F)c3)c(F)c2)cc1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ RARB P10826 10/20 0.52
▸ RARA P10276 2/20 0.52
▸ RARG P13631 1/20 0.52
▸ TSHR P16473 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ MAPT P10636 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ MTOR P42345 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ HTR2A P28223 1/20 0.40
▸ TAAR1 Q96RJ0 1/20 0.38
▸ HRH3 Q9Y5N1 1/20 0.38
▸ GPR84 Q9NQS5 1/20 0.38
▸ PLK1 P53350 1/20 0.37
▸ PLK3 Q9H4B4 1/20 0.37

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
SCHEMBL1816914 0.95 RARB (0.57) RARBRARARARGTSHRHSD17B10
SCHEMBL10030230 0.93 RARB (0.56) RARBRARARARGTSHRHSD17B10
SCHEMBL16258064 0.91 RARB (0.53) RARBRARARARGTSHRHSD17B10
SCHEMBL16258027 0.88 RARB (0.53) RARBRARARARGTSHRHSD17B10
SCHEMBL12198992 0.88 RARB (0.43) RARBRARARARGMAPT
SCHEMBL16258059 0.86 RARB (0.48) RARBRARARARGGPR84
SCHEMBL14175167 0.86 RARB (0.66) RARBRARARARGTSHRHSD17B10
SCHEMBL12622913 0.85 RARB (0.48) RARBRARARARGTSHRHSD17B10
SCHEMBL15461666 0.85 RARB (0.58) RARBRARARARGTSHRHSD17B10
SCHEMBL13239276 0.85 RARB (0.58) RARBRARARARGTSHRHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7951433-B2 Five-ring liquid crystal compound having CF2O bonding group, liquid crystal composition, and liquid crystal display device CHISSO CORPORATION (JP) 2011-05-31 — — US disclosed
US-20100127211-A1 FIVE-RING LIQUID CRYSTAL COMPOUND HAVING CF20 BONDING GROUP, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE CHISSO CORPORATION (JP) 2010-05-27 — — 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-20100127211-A1 FIVE-RING LIQUID CRYSTAL COMPOUND HAVING CF20 BONDING GROUP, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE CFAP20, KIF20A, KIF20B RARB 2364/4885RARA 1623/4885RARG 2760/4885

“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.

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