SCHEMBL145537

SCHEMBL145537

CCC(C)c1[c]c(C(C)CC)cc(C(C)CC)c1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.38
USP2 O75604 1/20 0.38
GAA P10253 1/20 0.38
PKM P14618 1/20 0.38
HPGD P15428 1/20 0.38
ALOX15 P16050 1/20 0.38
HSD17B10 Q99714 1/20 0.38
HDAC4 P56524 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
TSHR P16473 3/20 0.32
CYP2C9 P11712 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
SCHEMBL15067853 0.89 USP2 (0.35) ALDH1A1USP2GAAPKMHPGD
SCHEMBL5050251 0.86 USP2 (0.33) ALDH1A1USP2GAAPKMHPGD
SCHEMBL11686432 0.79 ALDH1A1 (0.46) ALDH1A1USP2GAAPKMHPGD
SCHEMBL4256624 0.76 TSHR (0.31) ALDH1A1USP2GAAPKMHPGD
SCHEMBL16167050 0.74
SCHEMBL28173687 0.74 ABCB11 (0.39)
SCHEMBL2695258 0.74 ALDH1A1 (0.42) ALDH1A1USP2GAAPKMHPGD
SCHEMBL184762 0.73 TSHR (0.41) ALDH1A1USP2GAAPKMHPGD
SCHEMBL4456298 0.73 USP2 (0.31) ALDH1A1USP2GAAPKMHPGD
SCHEMBL7790218 0.72 ALDH1A1 (0.42) ALDH1A1USP2GAAPKMHPGD

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 566 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240216900-A1 SABRE CATALYSTS CONTAINING FLUORINATED CARBON CHAINS FOR DELIVERY OF METAL-FREE MRI CONTRAST AGENTS THE U.S.A., AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2024-07-04 US claimed
WO-2023196594-A2 SABRE CATALYSTS CONTAINING FLUORINATED CARBON CHAINS FOR DELIVERY OF METAL-FREE MRI CONTRAST AGENTS THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2023-10-12 WO claimed
EP-3908566-B1 PREPARATION OF 5-ARYL PENTANOLS BASF SE (DE) 2023-07-26 EP claimed
CN-115385957-A Linear terphenyl aryl phosphine ligand and transition metal complex thereof 东莞市均成高新材料有限公司 2022-11-25 CN claimed
CN-115385955-A Tetrabiarylphosphine ligands and transition metal complexes thereof 东莞市均成高新材料有限公司 2022-11-25 CN claimed
CN-115385956-A Biaryl diphosphine ligands and transition metal complexes thereof 东莞市均成高新材料有限公司 2022-11-25 CN claimed
US-11365168-B2 Preparation of 5-aryl-pentanols BASF SE (DE) 2022-06-21 US claimed
CN-113260603-A Preparation of 5-arylpentanols 巴斯夫欧洲公司 2021-08-13 CN claimed
CN-111978953-A Long-afterglow luminescent composition based on BODIPY luminophor and application 复旦大学 2020-11-24 CN claimed
US-8344142-B2 perylenetetracarboxylic diimide core having side chains (groups or mesogens) attached to the core; to provide charge-transport materials having various volatilities, solubilities, crystallinity, and charge transport ability; organic light emitting diode; photovoltaic cells, light-emitting diodes GEORGIA TECH RESEARCH CORPORATION (US) 2013-01-01 US claimed
US-8039625-B2 Coronene charge-transport materials, methods of fabrication thereof, and methods of use thereof GEORGIA TECH RESEARCH CORPORATION (US) 2011-10-18 US claimed
US-20090044863-A1 CORONENE CHARGE-TRANSPORT MATERIALS, METHODS OF FABRICATION THEREOF, AND METHODS OF USE THEREOF NATIONAL SCIENCE FOUNDATION 2009-02-19 US claimed
US-20080223444-A1 Perylene Charge-Transport Materials, Methods of Fabrication Thereof, and Methods of Use Thereof GEORGIA TECH RESEARCH CORPORATION 2008-09-18 US claimed
WO-2006093965-A2 CORONENE CHARGE-TRANSPORT MATERIALS, METHODS OF FABRICATION THEREOF, AND METHODS OF USE THEREOF GEORGIA TECH RESEARCH CORPORATION (US) 2006-09-08 WO claimed
US-20060142159-A1 Plant-protective agents in the form of suspensions MEYER GERD R 2006-06-29 US claimed
WO-2005124453-A2 PERYLENE CHARGE-TRANSPORT MATERIALS, METHODS OF FABRICATION THEREOF, AND METHODS OF USE THEREOF GEORGIA TECH RESEARCH CORPORATION (US) 2005-12-29 WO claimed
US-20050182219-A1 Crystallization inhibitor for plant-protective formulations MEYER GERD R (DE) 2005-08-18 US claimed
US-20050148709-A1 Solid plant-protective formulations CLARIANT GMBH (DE) 2005-07-07 US claimed
WO-2005054370-A2 ANTIFOAMING AGENT CLARIANT PRODUKTE (DEUTSCHLAND) GMBH (DE) 2005-06-16 WO claimed
US-20050085391-A1 Aqueous plant-protection formulations MEYER GERD R (DE) 2005-04-21 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 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-20240216900-A1 SABRE CATALYSTS CONTAINING FLUORINATED CARBON CHAINS FOR DELIVERY OF METAL-FREE MRI CONTRAST AGENTS FABP7, FFAR1, FABP1 ALDH1A1 4484/4885USP2 4831/4885GAA 1861/4885
US-11365168-B2 Preparation of 5-aryl-pentanols HPD, CYP3A5, HTR3C ALDH1A1 127/4885USP2 1492/4885GAA 2815/4885
US-20080223444-A1 Perylene Charge-Transport Materials, Methods of Fabrication Thereof, and Methods of Use Thereof SLC43A1, SLC3A2, SLC16A3 ALDH1A1 1563/4885USP2 3600/4885GAA 2697/4885
US-20090044863-A1 CORONENE CHARGE-TRANSPORT MATERIALS, METHODS OF FABRICATION THEREOF, AND METHODS OF USE THEREOF SLC18A3, CORO1C, SLC18A1 ALDH1A1 2790/4885USP2 2321/4885GAA 2175/4885

“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.