SCHEMBL12822866

SCHEMBL12822866

CCCC(O)c1ccc(-c2ccc(OCC3CCC(c4ccc(C5CO5)c(F)c4)CC3)c(F)c2F)cc1

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ FPR2 P25090 3/20 0.34
▸ PDE4B Q07343 3/20 0.33
▸ PDE4A P27815 2/20 0.33
▸ PDE4C Q08493 2/20 0.33
▸ PDE4D Q08499 2/20 0.33
▸ ACACB O00763 1/20 0.30
▸ APP P05067 1/20 0.30
▸ CNR2 P34972 1/20 0.30

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
SCHEMBL13586560 0.94 PDE4B (0.33) FPR2PDE4BPDE4APDE4CPDE4D
SCHEMBL12717094 0.90 FPR2 (0.36) FPR2PDE4BACACBAPPCNR2
SCHEMBL12716540 0.89 PDE4B (0.33) FPR2PDE4BPDE4APDE4CPDE4D
SCHEMBL12821168 0.89 PDE4B (0.33) FPR2PDE4BPDE4APDE4CPDE4D
SCHEMBL12717399 0.88 KDM1A (0.38) FPR2PDE4BPDE4APDE4CPDE4D
SCHEMBL12821171 0.88 PDE4B (0.32) FPR2PDE4BPDE4APDE4CPDE4D
SCHEMBL12907064 0.87 FPR2 (0.33) FPR2PDE4BPDE4APDE4CPDE4D
SCHEMBL12823188 0.86 FPR2 (0.35) FPR2PDE4B
SCHEMBL13586577 0.86 APP (0.33) FPR2PDE4BPDE4APDE4CPDE4D
SCHEMBL12823365 0.85 PDE4A (0.32) PDE4BPDE4APDE4CPDE4DAPP

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 FPR2 589/4885PDE4B 2984/4885PDE4A 3366/4885

“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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