SCHEMBL562815

SCHEMBL562815

CC(C)(C)C#Cc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 1/20 0.55
▸ MAPT P10636 3/20 0.50
▸ NPC1 O15118 2/20 0.43
▸ MTOR P42345 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ KCNH2 Q12809 1/20 0.41
▸ CYP1A2 P05177 3/20 0.41
▸ CYP3A4 P08684 2/20 0.41
▸ CYP2C9 P11712 2/20 0.41
▸ CYP2C19 P33261 2/20 0.41
▸ THPO P40225 1/20 0.41
▸ HRH3 Q9Y5N1 2/20 0.40
▸ PTGES2 Q9H7Z7 2/20 0.40
▸ BLM P54132 1/20 0.39
▸ PMP22 Q01453 1/20 0.39
▸ GRM5 P41594 1/20 0.39
▸ CYP1A1 P04798 1/20 0.39
▸ CYP1B1 Q16678 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ HRH4 Q9H3N8 1/20 0.39

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
SCHEMBL4954449 0.86 HRH3 (0.47) APPMAPTCYP1A2HRH3PTGES2
SCHEMBL2183993 0.84 APP (0.55) APPMAPTNPC1MTORRAB9A
SCHEMBL4953884 0.82 HRH3 (0.49) APPMAPTKCNH2HRH3PTGES2
SCHEMBL3328592 0.80 APP (0.50) APPMAPTNPC1MTORRAB9A
SCHEMBL487465 0.80 MAPT (0.56) APPMAPTNPC1MTORRAB9A
SCHEMBL31257844 0.80 APP (0.50) APPMAPTNPC1MTORRAB9A
SCHEMBL9694697 0.77 GRM5 (0.45) MAPTNPC1KCNH2HRH3PTGES2
SCHEMBL9906153 0.77 MAPT (0.53) APPMAPTNPC1MTORRAB9A
SCHEMBL10518285 0.77 APP (0.46) APPMAPTNPC1MTORRAB9A
SCHEMBL12935540 0.77 MAPT (0.53) APPMAPTNPC1MTORRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3223328-B1 ORGANIC PHOTOVOLTAIC CELL AND MANUFACTURING METHOD THEREOF KOLON INC (KR) 2020-07-29 — — EP claimed
CN-110028394-A A kind of synthetic method of indone and its derivative 南京邮电大学 2019-07-19 — — CN claimed
CN-106699691-B A kind of synthetic method of alkynyl amidine compound 江南大学 2019-03-15 — — CN claimed
CN-105013535-B A kind of catalyst and its synthetic method for preparing asymmetric conjugation diine hydrocarbon compound 湖南大学 2018-02-02 — — CN claimed
EP-3223328-A1 ORGANIC PHOTOVOLTAIC CELL AND MANUFACTURING METHOD THEREOF Kolon Industries, Inc. (KR) 2017-09-27 — — EP claimed
WO-2013100284-A1 METHOD FOR MANUFACTURING ORGANIC SOLAR CELL AND THE ORGANIC SOLAR CELL MANUFACTURING BY USING THE SAME KOLON INDUSTRIES, INC. (KR) 2013-07-04 — — WO claimed
US-20130109198-A1 HIGH CARBON CONTENT MOLECULES FOR AMORPHOUS CARBON DEPOSITION AMERICAN AIR LIQUIDE, INC. (US) 2013-05-02 — — US claimed
US-8216686-B2 Conjugated dendron having no heteroatoms is coupled to the triphenylamine core; organic memory device includes an organic active layer between a first electrode and a second electrode, wherein the organic active layer includes the dendrimer; may be used as a nonvolatile memory SAMSUNG ELECTRONICS CO., LTD. (KR) 2012-07-10 — — US claimed
US-8124238-B2 Redox system ; dendrimer is connected to core by linker group SAMSUNG ELECTRONICS CO., LTD. (KR) 2012-02-28 — — US claimed
US-8044387-B1 Semiconductor device built on plastic substrate SPANSION LLC (US) 2011-10-25 — — US claimed
US-20030178667-A1 Memory device CYPRESS SEMICONDUCTOR CORPORATION 2003-09-25 — — US claimed
US-20030162994-A1 6,6'-Bis-(1-Phosphanorbornadiene) diphosphines, their preparation and their uses MATHEY FRANCOIS (FR) 2003-08-28 — — US claimed
US-20030155602-A1 Memory device COATUE CORPORATION 2003-08-21 — — US claimed
US-6521795-B2 Minimizing formation of enantiomer with use of catalyst comprising transition metals with chiral ligands RHODIA CHIMIE (FR) 2003-02-18 — — US claimed
US-20020042540-A1 New 6,6'-bis-(1-phosphanorbornadiene) diphosphines, their preparation and their uses MATHEY FRANCOIS (FR) 2002-04-11 — — US claimed
US-6288279-B1 THEIR PREPARATION PROCESS AND THEIR USE IN ASYMMETRICAL CATALYSIS. REARRANGING A DIPHOSPHOLE, REACTING THE DIPHOSPHOLE WITH AN ACETYLENIC COMPOUND TO FORM THE DIPHOSPHINE RHODIA CHIMIE (FR) 2001-09-11 — — US claimed
JP-2001513805-A — — 2001-09-04 — — JP claimed
EP-0968220-A1 6,6'-BIS-(1-PHOSPHANORBORNADIENE) DIPHOSPHINES RHODIA CHIMIE (FR) 2000-01-05 — — EP claimed
WO-1998039345-A1 6,6'-BIS-(1-PHOSPHANORBORNADIENE) DIPHOSPHINES RHODIA CHIMIE (FR) 1998-09-11 — — WO claimed
US-4725649-A BLEND OF RUBBER WITH TERT-BUTYLPHENOL-ACETYLENE RESIN BRIDGESTONE CORPORATION (JP) 1988-02-16 — — 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 (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-20020042540-A1 New 6,6'-bis-(1-phosphanorbornadiene) diphosphines, their preparation and their uses PHOSPHO1, DUS2, DCPS APP 4785/4885MAPT 4804/4885NPC1 3997/4885
US-20030162994-A1 6,6'-Bis-(1-Phosphanorbornadiene) diphosphines, their preparation and their uses DUS2, PHOSPHO1, DCPS APP 4754/4885MAPT 4784/4885NPC1 3824/4885

“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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