SCHEMBL20764876

SCHEMBL20764876

CCCCCCCCCCCC(=O)Oc1ccc2c(c1)Oc1cc(O)ccc1C21OC(=O)c2ccccc21

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.62
▸ MEN1 O00255 2/20 0.62
▸ HTT P42858 2/20 0.62
▸ KMT2A Q03164 2/20 0.62
▸ LMNA P02545 2/20 0.62
▸ ALDH1A1 P00352 2/20 0.62
▸ USP2 O75604 1/20 0.62
▸ FTO Q9C0B1 10/20 0.61
▸ HPGD P15428 2/20 0.61
▸ CYP2C19 P33261 1/20 0.61
▸ RECQL P46063 1/20 0.61
▸ BLM P54132 1/20 0.61
▸ SMAD3 P84022 1/20 0.61
▸ PRMT1 Q99873 1/20 0.61
▸ ACE2 Q9BYF1 1/20 0.61
▸ TDP1 Q9NUW8 1/20 0.61
▸ CYP3A4 P08684 1/20 0.58
▸ ITPR3 Q14573 1/20 0.49
▸ GSTP1 P09211 1/20 0.49
▸ ALOX12 P18054 2/20 0.47

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
SCHEMBL19128728 1.00 MAPT (0.62) MAPTMEN1HTTKMT2ALMNA
SCHEMBL5886623 1.00 MAPT (0.62) MAPTMEN1HTTKMT2ALMNA
SCHEMBL14776965 1.00 MAPT (0.62) MAPTMEN1HTTKMT2ALMNA
Fluorescein SCHEMBL19128335 1.00 MAPT (0.62) MAPTMEN1HTTKMT2ALMNA
SCHEMBL3866846 0.99 MAPT (0.63) MAPTMEN1HTTKMT2ALMNA
SCHEMBL29447210 0.95 KMT2A (0.68) MAPTMEN1HTTKMT2ALMNA
SCHEMBL1031936 0.95 KMT2A (0.68) MAPTMEN1HTTKMT2ALMNA
SCHEMBL1031682 0.95 KMT2A (0.68) MAPTMEN1HTTKMT2ALMNA
SCHEMBL30042784 0.95 KMT2A (0.68) MAPTMEN1HTTKMT2ALMNA
SCHEMBL459110 0.95 KMT2A (0.68) MAPTMEN1HTTKMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114880879-A Training method and system for pancreatic exocrine function evaluation model, electronic device and medium 中国人民解放军海军军医大学第一附属医院 2022-08-09 — — CN disclosed
US-20210018497-A1 BRET SENSOR MOLECULES FOR DETECTING HYDROLASES COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2021-01-21 — — US disclosed
EP-3673076-A1 BRET SENSOR MOLECULES FOR DETECTING HYDROLASES Commonwealth Scientific and Industrial Research Organisation (AU) 2020-07-01 — — EP disclosed
CN-111212917-A BRET sensor molecules for detecting hydrolases 联邦科学技术研究组织 2020-05-29 — — CN disclosed
CN-110693753-A Comprehensive anti-aging eye cream and preparation method thereof 南京阿奴生物科技有限公司 2020-01-17 — — CN disclosed
WO-2019036769-A1 BRET SENSOR MOLECULES FOR DETECTING HYDROLASES COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2019-02-28 — — WO disclosed
Send feedback