SCHEMBL5632682

SCHEMBL5632682

O=C1CCC(c2ccc3ccccc3c2)O1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ SLC6A4 P31645 8/20 0.48
▸ SLC6A2 P23975 7/20 0.48
▸ SLC6A3 Q01959 6/20 0.48
▸ KDM4E B2RXH2 1/20 0.40
▸ CYP2D6 P10635 2/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ HTR2C P28335 1/20 0.37
▸ HTR2B P41595 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ DRD2 P14416 1/20 0.37
▸ KCNH2 Q12809 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ DDB1 Q16531 1/20 0.36
▸ CRBN Q96SW2 1/20 0.36
▸ MMP13 P45452 1/20 0.36

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
SCHEMBL30874306 1.00 SLC6A4 (0.48) SLC6A4SLC6A2SLC6A3KDM4ECYP2D6
SCHEMBL29870462 1.00 SLC6A4 (0.48) SLC6A4SLC6A2SLC6A3KDM4ECYP2D6
SCHEMBL20721725 1.00 SLC6A4 (0.48) SLC6A4SLC6A2SLC6A3KDM4ECYP2D6
SCHEMBL9012682 0.78 TSHR (0.46) KDM4ETSHR
SCHEMBL7339250 0.78 TSHR (0.46) KDM4ETSHR
SCHEMBL982856 0.78 TSHR (0.46) KDM4ETSHR
SCHEMBL7259690 0.76 MEN1 (0.44) KDM4E
SCHEMBL28730834 0.76 MEN1 (0.44) KDM4E
SCHEMBL3152410 0.75 CYP2A6 (0.38) SLC6A4SLC6A2SLC6A3DRD2KCNH2
SCHEMBL9099294 0.75 SLC6A2 (0.41) SLC6A4SLC6A2SLC6A3CYP2D6CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117866177-A Biodegradable full polyester nano particle and preparation method and application thereof 复旦大学 2024-04-12 — — CN claimed
WO-2006052985-A1 LACTONES AS NEW OXYGENATE FUEL ADDITIVES, FUELS BASED THEREON AND METHODS FOR USING SAME THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2006-05-18 — — WO claimed
US-20060096158-A1 Lactones as new oxygenate fuel additives, fuels based thereon and methods for using same ROBINSON J M 2006-05-11 — — US claimed
US-6797745-B1 Hot melt inks containing styrene or terpene polymers XEROX CORPORATION 2004-09-28 — — US claimed
US-6461417-B1 Ink compositions XEROX CORPORATION 2002-10-08 — — US claimed
US-6117223-A Hot melt inks containing polyketones XEROX CORPORATION (US) 2000-09-12 — — US claimed
CN-117866177-A Biodegradable full polyester nano particle and preparation method and application thereof 复旦大学 2024-04-12 — — CN disclosed
US-7196196-B2 Substituted imidazo[1, 2-a]-5,6,7,8-tetrahydropyridine-8-ones, method for their production and the use thereof for producing imidazo[1,2-a]pyridines BASF AKTIENGESELLSCHAFT (DE) 2007-03-27 — — US disclosed
WO-2006052985-A1 LACTONES AS NEW OXYGENATE FUEL ADDITIVES, FUELS BASED THEREON AND METHODS FOR USING SAME THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2006-05-18 — — WO disclosed
US-20060096158-A1 Lactones as new oxygenate fuel additives, fuels based thereon and methods for using same ROBINSON J M 2006-05-11 — — US disclosed
US-20050020620-A1 Substituted imidazo[1, 2-a]-5,6,7,8-tetrahydropyridine-8-ones, method for their production and the use thereof for producing imidazo[1,2-a]pyridines BASF AKTIENGESELLSCHAFT (DE) 2005-01-27 — — US disclosed
US-6797745-B1 Hot melt inks containing styrene or terpene polymers XEROX CORPORATION 2004-09-28 — — US disclosed
US-6461417-B1 Ink compositions XEROX CORPORATION 2002-10-08 — — US disclosed
US-6117223-A Hot melt inks containing polyketones XEROX CORPORATION (US) 2000-09-12 — — 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-20050020620-A1 Substituted imidazo[1, 2-a]-5,6,7,8-tetrahydropyridine-8-ones, method for their production and the use thereof for producing imidazo[1,2-a]pyridines BTN3A1, DHPS, NISCH SLC6A4 4537/4885SLC6A2 4670/4885SLC6A3 4546/4885

“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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