SCHEMBL4569186

SCHEMBL4569186

CCCCC1CCC2CC(C3CCC(CCC(=O)OCC)CC3)CCC2C1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.43
EPHX2 P34913 1/20 0.42
ALDH1A1 P00352 3/20 0.40
TDP1 Q9NUW8 2/20 0.40
USP2 O75604 1/20 0.40
ALOX15 P16050 1/20 0.40
NAAA Q02083 1/20 0.38
SMYD3 Q9H7B4 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
CYP1A2 P05177 2/20 0.36
HPGD P15428 2/20 0.35
POLB P06746 1/20 0.35
TLR4 O00206 2/20 0.34
LMNA P02545 1/20 0.34
MAPK1 P28482 1/20 0.34
HTT P42858 1/20 0.34

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
SCHEMBL14864455 0.93 EPHX2 (0.43) MAPTEPHX2ALDH1A1TDP1USP2
SCHEMBL19853866 0.88 ALDH1A1 (0.47) MAPTEPHX2ALDH1A1TDP1USP2
SCHEMBL23533283 0.88 TDP1 (0.48) MAPTALDH1A1TDP1USP2ALOX15
SCHEMBL10073831 0.85 ALDH1A1 (0.46) MAPTEPHX2ALDH1A1TDP1USP2
SCHEMBL3476775 0.84 ALDH1A1 (0.43) MAPTEPHX2ALDH1A1TDP1USP2
SCHEMBL10793775 0.84 ALDH1A1 (0.50) MAPTALDH1A1TDP1USP2ALOX15
SCHEMBL10793779 0.84 ALDH1A1 (0.50) MAPTALDH1A1TDP1USP2ALOX15
SCHEMBL3912258 0.83 ALDH1A1 (0.42) EPHX2ALDH1A1TDP1USP2ALOX15
SCHEMBL25386620 0.82 ALDH1A1 (0.52) MAPTALDH1A1TDP1USP2ALOX15
SCHEMBL4572168 0.81 EPHX2 (0.36) MAPTEPHX2ALDH1A1TDP1USP2

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-8420854-B2 Di(meth)acrylate compound, polymerizable liquid crystal composition, optical anisotropic material, optical element and optical information writing/reading device ASAHI GLASS COMPANY, LIMITED (JP) 2013-04-16 US disclosed
US-20120123074-A1 DI(METH)ACRYLATE COMPOUND, POLYMERIZABLE LIQUID CRYSTAL COMPOSITION, OPTICAL ANISOTROPIC MATERIAL, OPTICAL ELEMENT AND OPTICAL INFORMATION WRITING/READING DEVICE ASAHI GLASS COMPANY, LIMITED (JP) 2012-05-17 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-20120123074-A1 DI(METH)ACRYLATE COMPOUND, POLYMERIZABLE LIQUID CRYSTAL COMPOSITION, OPTICAL ANISOTROPIC MATERIAL, OPTICAL ELEMENT AND OPTICAL INFORMATION WRITING/READING DEVICE METTL3, METTL14, METTL16 MAPT 119/4885EPHX2 3872/4885ALDH1A1 1361/4885

“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.