SCHEMBL4912196

SCHEMBL4912196

CCC(C)c1c(O)cc(C)c(C)c1C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.39
ALOX15 P16050 4/20 0.38
PKM P14618 3/20 0.38
ALDH1A1 P00352 2/20 0.38
HPGD P15428 2/20 0.38
HSD17B10 Q99714 2/20 0.38
GAA P10253 2/20 0.38
USP2 O75604 1/20 0.38
RORC P51449 1/20 0.37
HDAC4 P56524 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
LMNA P02545 1/20 0.33
CYP2D6 P10635 3/20 0.32
CYP2C9 P11712 3/20 0.32
CYP2C19 P33261 3/20 0.32
ALOX12 P18054 2/20 0.32
CYP1A2 P05177 2/20 0.32
CYP3A4 P08684 2/20 0.32
KDM4E B2RXH2 1/20 0.32

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
SCHEMBL1245081 0.79 LMNA (0.42) ALOX15PKMALDH1A1HPGDHSD17B10
SCHEMBL16010402 0.78 RXRA (0.42) TSHRALOX15PKMALDH1A1HPGD
SCHEMBL69861 0.77 TSHR (0.43) TSHRALOX15PKMALDH1A1HPGD
SCHEMBL5516689 0.74 MAPT (0.37) ALOX15PKMALDH1A1HPGDHSD17B10
SCHEMBL20621450 0.74 RXRA (0.46) TSHRALOX15PKMALDH1A1HPGD
SCHEMBL16018022 0.74 CYP3A4 (0.42) TSHRALOX15PKMALDH1A1HPGD
SCHEMBL29174139 0.72 TSHR (0.44) TSHRALOX15PKMALDH1A1HPGD
SCHEMBL9799079 0.72 LMNA (0.33) ALOX15PKMALDH1A1HPGDHSD17B10
SCHEMBL1244536 0.71 TSHR (0.52) TSHRALOX15PKMALDH1A1HPGD
SCHEMBL11701337 0.71 TSHR (0.52) TSHRALOX15PKMALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080312339-A1 FLUORINE-SUBSTITUTED ALKYL PHENOL COMPOUNDS AND THEIR USES BAKER MAX T 2008-12-18 US disclosed
US-7312250-B2 Fluorine-substituted alkyl phenol compounds and their uses UNIVERSITY OF IOWA RESEARCH FOUNDATION (US) 2007-12-25 US disclosed
WO-2003077894-A1 FLUORINE-SUBSTITUTED ALKYL PHENOL COMPOUNDS AND THEIR USES UNIVERSITY OF IOWA RESEARCH FOUNDATION (US) 2003-09-25 WO disclosed
US-20030176513-A1 Fluorine-substituted alkyl phenol compounds and their uses IOWA RESEARCH FOUNDATION, UNIVERSITY OF 2003-09-18 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 (2 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-20030176513-A1 Fluorine-substituted alkyl phenol compounds and their uses AFF4, AFF1, AFF2 TSHR 1138/4885ALOX15 559/4885PKM 1972/4885
US-20080312339-A1 FLUORINE-SUBSTITUTED ALKYL PHENOL COMPOUNDS AND THEIR USES AFF4, AFF1, AFF2 TSHR 1138/4885ALOX15 559/4885PKM 1972/4885

“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.