SCHEMBL84251

SCHEMBL84251

Nc1cc(N)cc(C(=O)c2ccc(C#Cc3ccccc3)cc2)c1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PBRM1 Q86U86 1/20 0.53
MAPT P10636 1/20 0.52
ASIC3 Q9UHC3 1/20 0.44
HNF4A P41235 1/20 0.44
ALDH1A1 P00352 1/20 0.43
FFAR1 O14842 5/20 0.43
GRM5 P41594 2/20 0.43
ATM Q13315 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
SRD5A2 P31213 1/20 0.42
ADORA1 P30542 1/20 0.41
APP P05067 1/20 0.41
PTGES O14684 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
FFAR4 Q5NUL3 1/20 0.41

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
SCHEMBL5744049 0.87 MAPT (0.69) PBRM1MAPTALDH1A1FFAR1GRM5
SCHEMBL8837231 0.87 PBRM1 (0.74) PBRM1MAPTASIC3ALDH1A1FFAR1
SCHEMBL1744898 0.83 ALDH1A1 (0.64) MAPTHNF4AALDH1A1FFAR1GRM5
SCHEMBL4354499 0.83 PBRM1 (0.73) PBRM1MAPTALDH1A1ATMTDP1
SCHEMBL84284 0.83 VCP (0.51) MAPTHNF4AALDH1A1FFAR1GRM5
SCHEMBL13284014 0.81 HNF4A (0.49) MAPTHNF4AALDH1A1FFAR1GRM5
SCHEMBL13284137 0.79 CNR1 (0.51) HNF4AALDH1A1FFAR1GRM5ATM
SCHEMBL8837213 0.79 MAPT (0.56) MAPTALDH1A1FFAR1TDP1SRD5A2
SCHEMBL5072017 0.78 LMNA (0.62) MAPTHNF4AALDH1A1FFAR1TDP1
SCHEMBL18561134 0.78 FFAR1 (0.47) MAPTASIC3ALDH1A1FFAR1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1189973-B1 COMPOSITION OF AND METHOD FOR MAKING HIGH PERFORMANCE RESINS FOR INFUSION AND TRANSFER MOLDING PROCESSES NASA (US) 2006-09-20 EP claimed
US-6441099-B1 LOW MOLECULAR WEIGHT PHENYLETHYNYL-CONTAINING POLYIMIDES OR POLYAMIC ACIDS; CURED FILM; USE WITH ANY PHENYLETHYNYL CONTAINING POLYMER TO IMPROVE MELT PROCESSABILITY THE UNITED STATES OF AMERICA AS REPRESENTED BY THE ADMINISTRATOR OF THE NATIONAL AERONAUTICS AND SPACE ADMINSTRATION 2002-08-27 US claimed
EP-1189973-A1 COMPOSITION OF AND METHOD FOR MAKING HIGH PERFORMANCE RESINS FOR INFUSION AND TRANSFER MOLDING PROCESSES The Government of the United States as represented by the Administrator of the National Aeronautics and Space Administration (US) 2002-03-27 EP claimed
US-6359107-B1 FOR FABRICATION OF COMPOSITE PARTS, SUCH AS FOR AEROSPACE APPLICATIONS THE UNITED STATES OF AMERICA AS REPRESENTED BY THE ADMINISTRATOR, NATIONAL AERONAUTICS AND SPACE ADMINISTRATION 2002-03-19 US claimed
US-6350817-B1 WHICH CAN BE USED WITH ANY PHENYLETHYNYL CONTAINING POLYMER, OR OLIGOMERS, TO DECREASE MELT FLOW AND CONSEQUENTLY PROCESSING PRESSURES REQUIRED TO FABRICATE MOLDED PARTS, ADHESIVE BONDS, AND FIBER REINFORCED COMPOSITE PARTS. THE UNITED STATES OF AMERICA AS REPRESENTED BY THE UNITED STATES NATIONAL AERONAUTICS AND SPACE ADMINISTRATION 2002-02-26 US claimed
WO-2000069948-A1 COMPOSITION OF AND METHOD FOR MAKING HIGH PERFORMANCE RESINS FOR INFUSION AND TRANSFER MOLDING PROCESSES THE GOVERNMENT OF THE UNITED STATES AS REPRESENTED BY THE ADMINISTRATOR OF THE NATIONAL AERONAUTICS AND SPACE ADMINISTRATION (US) 2000-11-23 WO claimed
US-6124035-A High temperature transfer molding resins THE UNITED STATES OF AMERICA AS REPRESENTED BY THE ADMINISTRATOR OF THE NATIONAL AERONAUTICS AND SPACE ADMINISTRATION (US) 2000-09-26 US claimed
US-11992995-B2 Lightly crosslinked polyimides with phenylethynyl pendants for shape-memory effect and programmed enhancement in Tg and modulus UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) 2024-05-28 US disclosed
US-20220388223-A1 Lightly Crosslinked Polyimides with Phenylethynyl Pendants for Shape-Memory Effect and Programmed Enhancement in Tg and Modulus GOVERNMENT OF THE UNITED STATES, AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE 2022-12-08 US disclosed
US-11504899-B1 Method for fabricating lightly crosslinked polyimides with phenylethynyl pendants for shape-memory effect and programmed enhancement in Tg and modulus UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) 2022-11-22 US disclosed
CN-112961347-B Low-viscosity high-temperature-resistant thermosetting polyimide resin and preparation method and application thereof 中国科学院化学研究所 2022-04-12 CN disclosed
CN-112961347-A Low-viscosity high-temperature-resistant thermosetting polyimide resin and preparation method and application thereof 中国科学院化学研究所 2021-06-15 CN disclosed
US-9255182-B2 Data storage medium and method for high density data storage INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2016-02-09 US disclosed
WO-2000069948-A1 COMPOSITION OF AND METHOD FOR MAKING HIGH PERFORMANCE RESINS FOR INFUSION AND TRANSFER MOLDING PROCESSES THE GOVERNMENT OF THE UNITED STATES AS REPRESENTED BY THE ADMINISTRATOR OF THE NATIONAL AERONAUTICS AND SPACE ADMINISTRATION (US) 2000-11-23 WO disclosed
US-6124035-A High temperature transfer molding resins THE UNITED STATES OF AMERICA AS REPRESENTED BY THE ADMINISTRATOR OF THE NATIONAL AERONAUTICS AND SPACE ADMINISTRATION (US) 2000-09-26 US disclosed
EP-0842212-A4 IMIDE OLIGOMERS AND CO-OLIGOMERS CONTAINING PENDENT PHENYLETHYNYL GROUPS AND POLYMERS THEREFROM NASA (US) 1998-10-14 EP disclosed
EP-0842212-A1 IMIDE OLIGOMERS AND CO-OLIGOMERS CONTAINING PENDENT PHENYLETHYNYL GROUPS AND POLYMERS THEREFROM NATIONAL AERONAUTICS AND SPACE ADMINISTRATION (US) 1998-05-20 EP disclosed
US-5689004-A CONTROLLED MOLECULAR WEIGHT IMIDE OLIGOMERS THE UNITED STATES OF AMERICA AS REPRESENTED BY THE ADMINISTRATOR OF THE NATIONAL AERONAUTICS AND SPACE ADMINISTRATION (US) 1997-11-18 US disclosed
US-5606014-A MOLECULAR WEIGHT CONTROL; CYCLODEHYDRATION THE UNITED STATES OF AMERICA AS REPRESENTED BY THE UNITED STATES NATIONAL AERONAUTICS AND SPACE ADMINISTRATION (US) 1997-02-25 US disclosed
WO-1997006200-A1 IMIDE OLIGOMERS AND CO-OLIGOMERS CONTAINING PENDENT PHENYLETHYNYL GROUPS AND POLYMERS THEREFROM NATIONAL AERONAUTICS & SPACE ADMINISTRATION (US) 1997-02-20 WO disclosed