SCHEMBL8822604

SCHEMBL8822604

COC(=O)c1cccc(C)c1Cc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.51
MAPT P10636 3/20 0.51
TSHR P16473 2/20 0.51
CYP1A2 P05177 1/20 0.51
CYP3A4 P08684 1/20 0.51
CYP2D6 P10635 1/20 0.51
CYP2C9 P11712 1/20 0.51
NFKB1 P19838 1/20 0.51
CYP2C19 P33261 1/20 0.51
BLM P54132 1/20 0.51
PMP22 Q01453 1/20 0.51
HIF1A Q16665 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
KDM4E B2RXH2 4/20 0.47
POLB P06746 2/20 0.47
ATM Q13315 1/20 0.47
GAA P10253 2/20 0.47
LMNA P02545 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.45

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
SCHEMBL7099019 0.84 SMN1; SMN2 (0.47) ALDH1A1MAPTTSHRCYP1A2CYP3A4
SCHEMBL3271724 0.83 ALDH1A1 (0.52) ALDH1A1TSHRCYP1A2CYP3A4CYP2C9
SCHEMBL8628652 0.83 KDM4E (0.46) ALDH1A1MAPTTSHRCYP1A2CYP3A4
SCHEMBL2228584 0.83 BRD4 (0.48) KDM4EPOLBGAAL3MBTL1MEN1
SCHEMBL11704260 0.82 KDM4E (0.45) ALDH1A1MAPTTSHRCYP1A2CYP3A4
SCHEMBL28682631 0.81 ALDH1A1 (0.58) ALDH1A1MAPTTSHRCYP1A2CYP3A4
SCHEMBL905244 0.80 ALDH1A1 (0.63) ALDH1A1MAPTTSHRCYP1A2CYP3A4
SCHEMBL7870569 0.80 ALDH1A1 (0.48) ALDH1A1MAPTTSHRKDM4EPOLB
SCHEMBL1607017 0.80 CA9 (0.50) ALDH1A1MAPTTSHRCYP1A2CYP3A4
SCHEMBL12174317 0.79 ALDH1A1 (0.47) ALDH1A1MAPTTSHRKDM4EPOLB

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116554063-B Preparation method of flusulfamuron intermediate 江苏省农用激素工程技术研究中心有限公司 2025-03-07 CN disclosed
CN-113015717-B Carboxylic acid ester compound, process for producing the same, and perfume composition 三菱瓦斯化学株式会社 2024-04-30 CN disclosed
CN-117480147-A Alicyclic alcohol, alicyclic alcohol composition, and perfume composition 三菱瓦斯化学株式会社 2024-01-30 CN disclosed
CN-116554063-A Preparation method of flusulfamuron intermediate 江苏省农用激素工程技术研究中心有限公司 2023-08-08 CN disclosed
CN-116368113-A Alicyclic alcohol, alicyclic alcohol composition, and perfume composition 三菱瓦斯化学株式会社 2023-06-30 CN disclosed
CN-105744983-B Device and method for sustained release of therapeutic agents of low water solubility in solubilizing agents 纳米医学系统公司 2019-12-27 CN disclosed
EP-0537585-B1 Process for preparing sulfonylureas DU PONT (US) 1997-08-20 EP disclosed
EP-0537585-A2 Process for preparing sulfonylureas E.I. DU PONT DE NEMOURS AND COMPANY (US) 1993-04-21 EP disclosed
US-5157119-A Process for preparing sulfonylureas E. I. DU PONT DE NEMOURS AND COMPANY (US) 1992-10-20 US disclosed