SCHEMBL7932656

SCHEMBL7932656

C#Cc1ccccc1-c1ccccc1C#C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
CDC25B P30305 2/20 0.33
ESR2 Q92731 1/20 0.33
HDAC8 Q9BY41 1/20 0.32
CYP2A6 P11509 1/20 0.32
ALDH1A1 P00352 2/20 0.32
NPC1 O15118 2/20 0.32
MAOA P21397 2/20 0.32
MAPK1 P28482 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
LMNA P02545 2/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
KDM4E B2RXH2 1/20 0.32
CES2 O00748 1/20 0.32
APAF1 O14727 1/20 0.32
TERT O14746 1/20 0.32
PLIN1 O60240 1/20 0.32
TDP2 O95551 1/20 0.32
S1PR4 O95977 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
SCHEMBL9862309 0.97 MEN1 (0.36) MEN1KMT2ACDC25BESR2HDAC8
SCHEMBL23151873 0.87 CYP2A6 (0.46) KMT2ACYP2A6ALDH1A1NPC1SMN1; SMN2
SCHEMBL10711051 0.87 DRD2 (0.30) DRD2DRD4DRD3
SCHEMBL3795851 0.85 CYP2A6 (0.44) ESR2HDAC8CYP2A6ALDH1A1MAPK1
SCHEMBL28545188 0.85 IDO1 (0.34) MEN1KMT2ACDC25BIDO1
SCHEMBL10434697 0.85 KDM4E (0.34) MEN1KMT2AALDH1A1NPC1MAPK1
SCHEMBL1302811 0.84 CYP2A6 (0.48) ESR2HDAC8CYP2A6ALDH1A1MAPK1
SCHEMBL29051242 0.84 ESR2 (0.38) ESR2CYP2A6
SCHEMBL30607044 0.84 ESR2 (0.38) ESR2CYP2A6
SCHEMBL28870 0.83 HDAC8 (0.36) MEN1KMT2AHDAC8CYP2A6ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4419504-A Method of accelerating cure rates for acetylene-terminated resins and curable compositions employed therein CELANESE CORPORATION (US) 1983-12-06 US claimed
US-4374291-A Synthesis of bis(ethynylphenyl) compounds HUGHES AIRCRAFT COMPANY (US) 1983-02-15 US claimed
US-4097460-A DIPHENYLACETYLENE, DIPHENYLBUTADIYNE, MOLDING MATERIALS FOR HIGH TEMPERATURE APPLICATIONS HERCULES INCORPORATED (US) 1978-06-27 US claimed
US-4070333-A AROMATIZATION CATALYST, ADDITION POLYMERIZATION HERCULES INCORPORATED (US) 1978-01-24 US claimed
CN-113402844-B Ablation-resistant resin with low expansion coefficient and preparation method thereof 航天特种材料及工艺技术研究所 2022-09-13 CN disclosed
CN-113402844-A Ablation-resistant resin with low expansion coefficient and preparation method thereof 航天特种材料及工艺技术研究所 2021-09-17 CN disclosed
WO-2016162810-A1 LUMINESCENT CONJUGATED MICROPOROUS POLYMER WITH LEWIS ACIDIC 'BORON' SITES ON THE PORE SURFACE: RATIOMETRIC SENSING AND CAPTURE OF F' ION JAWAHARLAL NEHRU CENTRE FOR ADVANCED SCIENTIFIC RESEARCH (IN) 2016-10-13 WO disclosed
EP-0834499-B1 Process for the preparation of aromatic vinyl compounds DAINIPPON INK & CHEMICALS (JP) 2001-07-25 EP disclosed
US-6246102-B1 Integrated circuits, transistors, data processing systems, printed wiring boards, digital computers, smart power devices, and processes of manufacture TEXAS INSTRUMENTS INCORPORATED 2001-06-12 US disclosed
EP-0977815-A1 ALKYL, ALKENYL AND ALKYNYL CHRYSAMINE G DERIVATIVES FOR THE ANTEMORTEM DIAGNOSIS OF ALZHEIMER'S DISEASE AND $i(IN VIVO) IMAGING AND PREVENTION OF AMYLOID DEPOSITION UNIVERSITY OF PITTSBURGH (US) 2000-02-09 EP disclosed
WO-1998047969-A1 ALKYL, ALKENYL AND ALKYNYL CHRYSAMINE G DERIVATIVES FOR THE ANTEMORTEM DIAGNOSIS OF ALZHEIMER'S DISEASE AND IN VIVO IMAGING AND PREVENTION OF AMYLOID DEPOSITION UNIVERSITY OF PITTSBURGH (US) 1998-10-29 WO disclosed
EP-0834499-A1 Process for the preparation of aromatic vinyl compounds DAINIPPON INK AND CHEMICALS, INC. (JP) 1998-04-08 EP disclosed
US-4097460-A DIPHENYLACETYLENE, DIPHENYLBUTADIYNE, MOLDING MATERIALS FOR HIGH TEMPERATURE APPLICATIONS HERCULES INCORPORATED (US) 1978-06-27 US disclosed
US-4070333-A AROMATIZATION CATALYST, ADDITION POLYMERIZATION HERCULES INCORPORATED (US) 1978-01-24 US disclosed
US-4026860-A AROMATIZATION CATALYST HERCULES INCORPORATED (US) 1977-05-31 US disclosed
US-4026859-A AROMATIZATION CATALYST HERCULES INCORPORATED (US) 1977-05-31 US disclosed
US-4026861-A AROMATIZATION CATALYST HERCULES INCORPORATED (US) 1977-05-31 US disclosed
US-4011378-A AROMATIZED POLYACETYLENES GENERAL ELECTRIC COMPANY (US) 1977-03-08 US disclosed
US-3993711-A THERMOSETTING RESINS; COUPLING AGENTS; CARBOXYLATED PREPOLYMER HERCULES INCORPORATED (US) 1976-11-23 US disclosed
US-3931093-A CURING HERCULES INCORPORATED (US) 1976-01-06 US disclosed