SCHEMBL14867225

SCHEMBL14867225

CCCCCC1CCC(C2CCC(C)CC2F)CC1

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 3/20 0.35
▸ HTT P42858 2/20 0.34
▸ LMNA P02545 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ PKM P14618 1/20 0.32
▸ MEN1 O00255 2/20 0.31
▸ KMT2A Q03164 2/20 0.31
▸ CYP2D6 P10635 1/20 0.31
▸ CYP2C9 P11712 1/20 0.31
▸ CYP2C19 P33261 1/20 0.31
▸ TP53 P04637 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
SCHEMBL13463955 0.91 CYP1A2 (0.33) CYP1A2HTTLMNAMAPK1PKM
SCHEMBL18973396 0.89 TLR4 (0.31) —
SCHEMBL16071827 0.88 — —
SCHEMBL16071711 0.88 — —
SCHEMBL16072371 0.88 — —
SCHEMBL13463953 0.87 CYP1A2 (0.37) CYP1A2HTTLMNAMAPK1PKM
SCHEMBL13463941 0.86 CYP1A2 (0.38) CYP1A2HTTLMNAMAPK1
SCHEMBL13463947 0.86 CYP1A2 (0.38) CYP1A2HTTLMNAMAPK1
SCHEMBL13464034 0.86 CYP1A2 (0.40) CYP1A2HTTLMNAMAPK1PKM
SCHEMBL9613652 0.85 — —

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-8858829-B2 Cyclohexane compound and liquid crystal composition containing the same ORGANO SCIENCE CO., LTD. (JP) 2014-10-14 — — US disclosed
US-20130092875-A1 CYCLOHEXANE COMPOUND AND LIQUID CRYSTAL COMPOSITION CONTAINING THE SAME CHIRACOL CO., LTD. (JP) 2013-04-18 — — 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-20130092875-A1 CYCLOHEXANE COMPOUND AND LIQUID CRYSTAL COMPOSITION CONTAINING THE SAME CNOT1, SCO2, CNOT9 CYP1A2 449/4885HTT 4318/4885LMNA 1926/4885

“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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