SCHEMBL673209

SCHEMBL673209

Oc1ccccc1C#Cc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 4/20 0.59
APP P05067 1/20 0.57
NPC1 O15118 4/20 0.56
MAPT P10636 4/20 0.56
ALDH1A1 P00352 4/20 0.56
CYP3A4 P08684 3/20 0.56
HPGD P15428 3/20 0.56
HSD17B10 Q99714 3/20 0.56
KDM4E B2RXH2 3/20 0.56
MEN1 O00255 2/20 0.56
CYP1A2 P05177 2/20 0.56
CYP2C9 P11712 2/20 0.56
CYP2C19 P33261 2/20 0.56
KMT2A Q03164 2/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
CA12 O43570 3/20 0.52
CA2 P00918 3/20 0.52
RAB9A P51151 3/20 0.52
CA9 Q16790 2/20 0.52
HNF4A P41235 1/20 0.46

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
Acetic Acid SCHEMBL28454105 0.90 FFAR1 (0.59) FFAR1APPNPC1MAPTALDH1A1
SCHEMBL15688668 0.87 ALDH1A1 (0.53) FFAR1NPC1MAPTALDH1A1CYP3A4
Cadaverine Tartrate SCHEMBL30558757 0.85 FFAR1 (0.55) FFAR1APPNPC1MAPTALDH1A1
SCHEMBL951002 0.85 ALDH1A1 (0.50) FFAR1APPNPC1MAPTALDH1A1
SCHEMBL29102410 0.83 FFAR1 (0.49) FFAR1APPNPC1MAPTALDH1A1
SCHEMBL28933373 0.83 FFAR1 (0.53) FFAR1APPNPC1MAPTALDH1A1
SCHEMBL28933420 0.83 CA12 (0.57) FFAR1NPC1MAPTALDH1A1CYP3A4
SCHEMBL28933437 0.83 FFAR1 (0.53) FFAR1APPNPC1MAPTALDH1A1
SCHEMBL2114742 0.82 APP (0.75) FFAR1APPNPC1MAPTALDH1A1
SCHEMBL5871989 0.82 APP (0.75) FFAR1APPNPC1MAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010086385-A9 CROSS-LINKABLE AROMATIC POLYCARBONATE NEXAM CHEMICALS AB (SE) 2010-10-07 WO claimed
WO-2010086385-A1 CROSS-LINKABLE AROMATIC POLYCARBONATE NEXAM CHEMICALS AB (SE) 2010-08-05 WO claimed
WO-2010087742-A1 ACETYLENIC AROMATIC POLYCARBONATE NEXAM CHEMICAL AB (SE) 2010-08-05 WO claimed
WO-2010074625-A1 ACETYLENIC AROMATIC POLYETHER NEXAM CHEMICAL AB (SE) 2010-07-01 WO claimed
WO-2010071532-A1 ACETYLENIC PHENOL-ALDEHYDE RESIN NEXAM CHEMICAL AB (SE) 2010-06-24 WO claimed
WO-2010030216-A1 ACETYLENIC POLY(ALKYLENE PHTHALATE) NEXAM CHEMICAL AB (SE) 2010-03-18 WO claimed
US-6946534-B2 Fluorinated polyethers having perfluorinated aliphatic group and optical waveguide using the same Kim, Mi-Hwa (KR) 2005-09-20 US claimed
US-6512076-B2 Condensation polymerization of a pentafluorophenyl sulfide and pentafluorophenyl sulfone monomer with dihydroxy monomer; heat, solvent and water resistance; use to make waveguides KWANGJU INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2003-01-28 US claimed
US-20020115815-A1 Poly (arylene ether sulfide) and poly (arylene ether sulfone) for optical device and method for preparing the same KWAGJU INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2002-08-22 US claimed
EP-1219665-A2 Poly (arylene ether sulfide) and poly (arylene ether sulfone) for optical device and method for preparing the same Kwangju Institute of Science and Technology (KR) 2002-07-03 EP claimed
US-20020057882-A1 Fluorinated polyethers having perfluorinated aliphatic group and optical waveguide using the same ZEN PHOTONICS CO. LTD. (KR) 2002-05-16 US claimed
CN-115448952-B Pentacoordinate phosphorus heterocyclic compound with fluorescence property and synthesis method thereof 江西科技师范大学 2025-05-13 CN disclosed
CN-111526873-B For modulating microbial colonization substituted diphenylacetylenes of (2) 生物曼迪克斯有限责任公司 2025-03-04 CN disclosed
WO-2024261504-A1 BENZOFURAN-3-CARBOXYLIC ACID AMIDES AND BENZOFURAN-3- CARBONYL-BENZAMIDES, METHOD FOR THEIR PRODUCTION WITH HIGH SELECTIVITY, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM PÉCSI TUDOMÁNYEGYETEM (HU) 2024-12-26 WO disclosed
EP-3280402-B1 TOLAN COMPOUNDS FOR PROMOTING WOUND HEALING BIOMENDICS LLC (US) 2024-06-05 EP disclosed
WO-1998050365-A9 PREPARATION OF FUSED POLYCYCLIC ALKALOIDS BY RING CLOSURE OF AZOMETHINE YLIDES, NOVEL COMPOUNDS THEREOF AND THEIR USE AS CHEMOTHERAPEUTIC AGENTS UNIV AUSTRALIAN (AU) 2000-02-03 WO disclosed
WO-1998050365-A1 PREPARATION OF FUSED POLYCYCLIC ALKALOIDS BY RING CLOSURE OF AZOMETHINE YLIDES, NOVEL COMPOUNDS THEREOF AND THEIR USE AS CHEMOTHERAPEUTIC AGENTS THE AUSTRALIAN NATIONAL UNIVERSITY (AU) 1998-11-12 WO disclosed
EP-0171209-B1 ACETYLENIC PHENOXYPROPANOL DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS FOR THE TREATMENT OF HYPERTENSION McNeilab, Inc. (US) 1989-03-01 EP disclosed
US-4652584-A Acetylenic phenoxypropanol derivatives and pharmaceutical compositions for the treatment of hypertension MCNEILAB, INC. (US) 1987-03-24 US disclosed
EP-0171209-A1 Acetylenic phenoxypropanol derivatives and pharmaceutical compositions for the treatment of hypertension McNeilab, Inc. (US) 1986-02-12 EP disclosed