SCHEMBL3262787

SCHEMBL3262787

C1CCC(C2CCC3CCCCC3C2)CC1

nearest known ligand 0.61

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.61
HSD11B1 P28845 1/20 0.34
ALOX5 P09917 1/20 0.34
SLC18A3 Q16572 1/20 0.33
CYP2D6 P10635 3/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
LMNA P02545 1/20 0.32
HSD17B10 Q99714 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
SCHEMBL3262784 1.00 ALDH1A1 (0.61) ALDH1A1HSD11B1ALOX5SLC18A3CYP2D6
SCHEMBL9579128 1.00 ALDH1A1 (0.61) ALDH1A1HSD11B1ALOX5SLC18A3CYP2D6
SCHEMBL6380069 1.00 ALDH1A1 (0.61) ALDH1A1HSD11B1ALOX5SLC18A3CYP2D6
SCHEMBL20720467 0.96 ALDH1A1 (0.57) ALDH1A1HSD11B1ALOX5SLC18A3CYP2D6
Ammonia Solution, Strong SCHEMBL29208008 0.96 ALDH1A1 (0.57) ALDH1A1HSD11B1ALOX5SLC18A3CYP2D6
SCHEMBL2991559 0.96 ALDH1A1 (0.67) ALDH1A1HSD11B1ALOX5CYP2D6MEN1
SCHEMBL6688258 0.96 ALDH1A1 (0.67) ALDH1A1HSD11B1ALOX5CYP2D6MEN1
SCHEMBL1629257 0.96 ALDH1A1 (0.67) ALDH1A1HSD11B1ALOX5SLC18A3CYP2D6
SCHEMBL6263692 0.92 ALDH1A1 (0.61) ALDH1A1HSD11B1ALOX5CYP2D6MEN1
SCHEMBL9140661 0.92 ALDH1A1 (0.61) ALDH1A1HSD11B1ALOX5SLC18A3CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1373175-B1 2,4'-SUBSTITUTED 6-CYCLOHEXYL-TRANS-DECALINES MERCK PATENT GMBH (DE) 2009-07-08 EP claimed
US-6916513-B2 High dielectric anisotropy and low birefringence; liquid crystal mixtures MERCK PATENT GMBH (DE) 2005-07-12 US claimed
US-20040119050-A1 liquid-crystal display element and an electro-optical display element. MERCH PATENT GMBH (DE) 2004-06-24 US claimed
CN-119842423-A High-density fuel oil and preparation method thereof 陕西煤基特种燃料研究院有限公司 2025-04-18 CN disclosed
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
EP-1780193-B1 LIQUID CRYSTAL MATERIAL, METHOD FOR PRODUCING LIQUID CRYSTAL MATERIAL AND LIQUID CRYSTAL DEVICE JAPAN SCIENCE & TECH AGENCY (JP) 2010-05-19 EP disclosed
EP-1373175-B1 2,4'-SUBSTITUTED 6-CYCLOHEXYL-TRANS-DECALINES MERCK PATENT GMBH (DE) 2009-07-08 EP disclosed
US-6916513-B2 High dielectric anisotropy and low birefringence; liquid crystal mixtures MERCK PATENT GMBH (DE) 2005-07-12 US disclosed
US-6916513-B2 High dielectric anisotropy and low birefringence; liquid crystal mixtures MERCK PATENT GMBH (DE) 2005-07-12 US disclosed
US-6916513-B2 High dielectric anisotropy and low birefringence; liquid crystal mixtures MERCK PATENT GMBH (DE) 2005-07-12 US disclosed
US-20040119050-A1 liquid-crystal display element and an electro-optical display element. MERCH PATENT GMBH (DE) 2004-06-24 US disclosed
US-20040119050-A1 liquid-crystal display element and an electro-optical display element. MERCH PATENT GMBH (DE) 2004-06-24 US disclosed
US-20040119050-A1 liquid-crystal display element and an electro-optical display element. MERCH PATENT GMBH (DE) 2004-06-24 US disclosed
EP-1373175-A2 2,4'-SUBSTITUTED 6-CYCLOHEXYL-TRANS-DECALINES MERCK PATENT GmbH (DE) 2004-01-02 EP disclosed
WO-2002081418-A3 2,4'-SUBSTITUTED 6-CYCLOHEXYL-TRANS-DECALINES MERCK PATENT GMBH (DE) 2003-04-17 WO disclosed
WO-2002081418-A2 2,4'-SUBSTITUTED 6-CYCLOHEXYL-TRANS-DECALINES MERCK PATENT GMBH (DE) 2002-10-17 WO 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-20040119050-A1 liquid-crystal display element and an electro-optical display element. CXCR1, DERL1, TTI2 ALDH1A1 1363/4885HSD11B1 2059/4885ALOX5 3742/4885

“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.