SCHEMBL4451679

SCHEMBL4451679

O=C(O)C1(c2ccccc2)C=CC=CC1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 5/20 0.41
AKR1C1 Q04828 1/20 0.40
LMNA P02545 1/20 0.35
HTT P42858 1/20 0.35
HDAC9 Q9UKV0 1/20 0.35
HSD11B1 P28845 2/20 0.33
MAPK1 P28482 1/20 0.32
OPRM1 P35372 1/20 0.32
OPRL1 P41146 1/20 0.32
KMT2A Q03164 1/20 0.31

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
Benzene SCHEMBL28354853 1.00 HDAC4 (0.41) HDAC4AKR1C1LMNAHTTHDAC9
SCHEMBL29120630 0.86 HDAC4 (0.39) HDAC4AKR1C1LMNAHTTHDAC9
SCHEMBL15529967 0.86 HDAC4 (0.39) HDAC4AKR1C1LMNAHTTHDAC9
SCHEMBL3836530 0.86 HDAC4 (0.39) HDAC4AKR1C1HDAC9HSD11B1OPRM1
SCHEMBL9458297 0.86 APP (0.33)
SCHEMBL9029796 0.84 HSD11B1 (0.38) LMNAHSD11B1OPRM1OPRL1
SCHEMBL2783202 0.84 TSHR (0.40)
SCHEMBL29531155 0.84 HDAC4 (0.38) HDAC4AKR1C1LMNAHDAC9MAPK1
SCHEMBL28878362 0.81 HDAC4 (0.33) HDAC4
SCHEMBL28916077 0.81 HDAC4 (0.33) HDAC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114890856-B Method for synthesizing 2,2' -biphenyl-1-carboxylic acid derivative 华南理工大学 2023-08-22 CN claimed
CN-114890856-A Method for synthesizing 2,2' -biphenyl-1-carboxylic acid derivative 华南理工大学 2022-08-12 CN claimed
US-20240197868-A1 IMMUNOGENIC COMPOSITION CONTAINING AN ANTIGEN AND AN ADJUVANT COMPRISING AL-MOFS UNIVERSITE DE VERSAILLES-SAINT-QUENTIN-EN-YVELINES (FR) 2024-06-20 US disclosed
EP-4313133-A2 IMMUNOGENIC COMPOSITION CONTAINING AN ANTIGEN AND AN ADJUVANT COMPRISING AL-MOFS UNIVERSITE DE VERSAILLES-SAINT QUENTIN EN YVELINES (FR) 2024-02-07 EP disclosed
EP-3663631-B1 GAS STORAGE CONTAINER ATOMIS INC (JP) 2023-10-11 EP disclosed
WO-2022207922-A2 IMMUNOGENIC COMPOSITION CONTAINING AN ANTIGEN AND AN ADJUVANT COMPRISING AL-MOFs UNIVERSITE DE VERSAILLES-SAINT-QUENTIN-EN-YVELINES (FR) 2022-10-06 WO disclosed
CN-114630819-A Benzamide derivatives for preventing or treating cancer, preparation method thereof, and pharmaceutical composition comprising the same as active ingredient 韩国化学研究院 2022-06-14 CN disclosed
EP-3814331-A1 NOVEL LXR MODULATORS WITH BICYCLIC CORE MOIETY Phenex-FXR GmbH (DE) 2021-05-05 EP disclosed
CN-109851560-B Biphenyl diazole derivative and preparation method and application thereof 河南新天地药业股份有限公司 2020-07-07 CN disclosed
EP-1608617-B1 MUSCARINIC AGONISTS LILLY CO ELI (US) 2013-01-09 EP disclosed
US-7569327-B2 Curable polymer compound SHOWDA DENKO K.K. (JP) 2009-08-04 US disclosed
EP-1608617-A1 MUSCARINIC AGONISTS ELI LILLY AND COMPANY (US) 2005-12-28 EP disclosed
EP-1546086-A2 AMINOALCOHOL DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2005-06-29 EP disclosed
WO-2004106431-A2 CURABLE POLYMER COMPOUND SHOWA DENKO K.K. (JP) 2004-12-09 WO disclosed
US-20040235980-A1 Polymerizable compound, polymerizable composition and cured product containing the compound SHOWA DENKO K.K. (JP) 2004-11-25 US disclosed
WO-2004094363-A1 MUSCARINIC AGONISTS ELI LILLY AND COMPANY (US) 2004-11-04 WO disclosed
CN-1533373-A Polymerizable compound, polymerizable composition containing the same, and cured product 昭和电工株式会社 2004-09-29 CN disclosed
WO-2004002939-A2 AMINOALCOHOL DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-01-08 WO disclosed
WO-2003010124-A1 POLYMERIZABLE COMPOUND, polymeRIZABLE COMPOSITION AND CURED PRODUCT CONTAINING THE COMPOUND SHOWA DENKO K. K. (JP) 2003-02-06 WO disclosed
US-5817674-A ANTIOTENSIN II RECEPTOR ANTAGONISTS ROUSSEL UCLAF (FR) 1998-10-06 US disclosed