SCHEMBL12823817

SCHEMBL12823817

CCCC(O)c1ccc(-c2ccc(-c3ccc(OCc4ccc(O)cc4F)cc3)c(F)c2F)cc1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 9/20 0.40
▸ FFAR1 O14842 1/20 0.38
▸ MAOB P27338 1/20 0.38
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ ESR2 Q92731 1/20 0.36
▸ APP P05067 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ USP7 Q93009 1/20 0.35

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
SCHEMBL12823077 0.96 ESR1 (0.39) ESR1FFAR1MAOBMEN1KMT2A
SCHEMBL12823853 0.90 MEN1 (0.43) FFAR1MAOBMEN1KMT2A
SCHEMBL10303206 0.89 FFAR1 (0.39) FFAR1MAOBMEN1KMT2AAPP
SCHEMBL12823334 0.86 MEN1 (0.42) FFAR1MAOBMEN1KMT2AAPP
SCHEMBL10303207 0.86 FFAR1 (0.39) FFAR1MAOBMEN1KMT2AAPP
SCHEMBL12823457 0.86 ESR1 (0.36) ESR1ESR2APPCYP3A4CYP2C9
SCHEMBL12823848 0.86 MEN1 (0.37) FFAR1MEN1KMT2A
SCHEMBL12821217 0.86 MEN1 (0.37) FFAR1MEN1KMT2A
SCHEMBL12823068 0.85 CYP17A1 (0.39) ESR1FFAR1MEN1KMT2AESR2
SCHEMBL12718968 0.84 FFAR4 (0.36) FFAR1MAOBMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110090450-A1 FOUR-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2011-04-21 — — 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-20110090450-A1 FOUR-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE LEF1, LAS1L, EFHD2 ESR1 1665/4885FFAR1 247/4885MAOB 3160/4885

“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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