SCHEMBL982199

SCHEMBL982199

Cc1cccc(-c2[c]cccc2)c1C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.37
ATM Q13315 1/20 0.37
TSHR P16473 2/20 0.36
ACHE P22303 1/20 0.36
P2RX7 Q99572 1/20 0.35
SLC9A1 P19634 1/20 0.33
NUDT1 P36639 4/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
MYC P01106 1/20 0.32
NPC1 O15118 1/20 0.32
CASP3 P42574 1/20 0.32
RAB9A P51151 1/20 0.32
SENP8 Q96LD8 1/20 0.32
SENP7 Q9BQF6 1/20 0.32
SENP6 Q9GZR1 1/20 0.32
CYP2A6 P11509 2/20 0.32
ALDH1A1 P00352 1/20 0.32
CYP1A2 P05177 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
SCHEMBL981109 0.87 TSHR (0.39) ATMTSHRACHEMEN1KMT2A
SCHEMBL12816261 0.86 CYP1A2 (0.33) TSHRCYP2A6CYP1A2
SCHEMBL2761711 0.79 MEN1 (0.32) MEN1KMT2ASMN1; SMN2NPC1RAB9A
SCHEMBL16020781 0.79 ACHE (0.34) TRPA1ATMACHESLC9A1NUDT1
SCHEMBL3223109 0.78 CYP1A2 (0.40) TSHRACHEMYCCYP2A6ALDH1A1
SCHEMBL8855149 0.77 MEN1 (0.35) ATMTSHRMEN1KMT2ASMN1; SMN2
SCHEMBL322239 0.77 MEN1 (0.35) ATMTSHRMEN1KMT2ASMN1; SMN2
SCHEMBL12815423 0.76
SCHEMBL8129595 0.76 ACHE (0.35) TRPA1ATMTSHRACHESLC9A1
SCHEMBL2320151 0.76 NUDT1 (0.32) TRPA1ATMSLC9A1NUDT1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115322195-A Compound and application thereof 北京鼎材科技有限公司 2022-11-11 CN claimed
EP-3560900-B1 SEALING MATERIAL FOR MULTI-LAYERED GLASSES, AND MULTI-LAYERED GLASS DAINIPPON INK & CHEMICALS (JP) 2023-08-30 EP disclosed
CN-115448956-A Molecular arrangement of homoleptic iridium phosphors 南加州大学 2022-12-09 CN disclosed
CN-115322195-A Compound and application thereof 北京鼎材科技有限公司 2022-11-11 CN disclosed
CN-110099878-B Sealing material for laminated glass and laminated glass DIC株式会社 2021-12-14 CN disclosed
US-10982123-B2 Sealing material for multi-layered glasses, and multi-layered glass DIC CORPORATION (JP) 2021-04-20 US disclosed
CN-111560031-A Polycyclic aromatic compound, reactive compound, polymer compound, crosslinked polymer, and use thereof 学校法人关西学院 2020-08-21 CN disclosed
US-20200040239-A1 SEALING MATERIAL FOR MULTI-LAYERED GLASSES, AND MULTI-LAYERED GLASS DIC CORPORATION (JP) 2020-02-06 US disclosed
EP-3560900-A1 SEALING MATERIAL FOR MULTI-LAYERED GLASSES, AND MULTI-LAYERED GLASS DIC Corporation (JP) 2019-10-30 EP disclosed
EP-2275406-B1 PROCESS FOR PRODUCING ISOCYANATE ASAHI CHEMICAL IND (JP) 2018-11-28 EP disclosed
WO-2007068890-A1 ANTIMICROBIAL POLYURETHANE FOAMS ETHICON, INC. (US) 2007-06-21 WO disclosed
WO-2006129120-A9 BENZOTRIAZEPINONE DERIVATIVES JAMES BLACK FOUNDATION (GB) 2007-03-22 WO disclosed
WO-2006129120-A2 BENZOTRIAZEPINONE DERIVATIVES JAMES BLACK FOUNDATION (GB) 2006-12-07 WO disclosed
US-6846619-B2 Dye dispersion liquid and thermosensitive recording material using the same RICOH COMPANY, LTD. (JP) 2005-01-25 US disclosed
EP-1243437-B1 Leuco dye dispersion liquid and thermosensitive recording material using the same RICOH KK (JP) 2004-11-17 EP disclosed
EP-1028945-A1 SUBSTITUTED PYRIDINE COMPOUNDS AS ANTI-INFLAMMATORY AGENTS Amgen Inc. (US) 2000-08-23 EP disclosed
WO-1999024404-A1 SUBSTITUTED PYRIDINE COMPOUNDS AS ANTI-INFLAMMATORY AGENTS AMGEN INC. (US) 1999-05-20 WO disclosed
US-4806552-A ANTIDEPRESSANTS JOHN WYETH & BROTHER, LIMITED (GB) 1989-02-21 US disclosed
US-4524168-A AZO DYES CIBA-GEIGY CORPORATION (US) 1985-06-18 US disclosed
US-4072027-A FLUOROCARBON REFRIGERANT, ASSYMETRICAL FURAN DERIVATIVE AS ABSORBENT ALLIED CHEMICAL CORPORATION (US) 1978-02-07 US disclosed