SCHEMBL8016485

SCHEMBL8016485

NP(N)(=S)N(c1ccccc1)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.42
L3MBTL1 Q9Y468 4/20 0.42
MAPT P10636 2/20 0.42
CYP3A4 P08684 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
KDM4E B2RXH2 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
HTT P42858 1/20 0.37
TSHR P16473 1/20 0.36
GAA P10253 1/20 0.34
HPGD P15428 1/20 0.34
ALOX15 P16050 2/20 0.33
NPSR1 Q6W5P4 1/20 0.33
FAAH O00519 1/20 0.32
PHGDH O43175 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
SCHEMBL6830787 0.74 ALDH1A1 (0.37) ALDH1A1L3MBTL1MAPTCYP3A4TDP1
SCHEMBL96680 0.74 HTT (0.48) ALDH1A1L3MBTL1MAPTCYP3A4TDP1
SCHEMBL465455 0.73 NPSR1 (0.41) ALDH1A1L3MBTL1MAPTCYP3A4TDP1
Hydrochloric Acid SCHEMBL27416015 0.72 HTT (0.46) ALDH1A1L3MBTL1MAPTCYP3A4TDP1
SCHEMBL15052257 0.69 HTT (0.43) ALDH1A1L3MBTL1MAPTCYP3A4TDP1
SCHEMBL8370301 0.67 HTT (0.59) ALDH1A1L3MBTL1MAPTCYP3A4TDP1
SCHEMBL8532403 0.64 ALDH1A1 (0.46) ALDH1A1L3MBTL1MAPTCYP3A4TDP1
SCHEMBL7081836 0.63 ALDH1A1 (0.37) ALDH1A1L3MBTL1MAPTCYP3A4TDP1
SCHEMBL3082968 0.63 MEN1 (0.42) ALDH1A1L3MBTL1MAPTTDP1MEN1
SCHEMBL18889454 0.63 HTT (0.54) ALDH1A1L3MBTL1MAPTCYP3A4TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109071622-B Peptides with anticancer activity IDP研发制药有限公司(ES) 2023-01-13 CN disclosed
CN-114929672-A Cancer therapy targeting cancer stem cells 治疗方案股份有限公司 2022-08-19 CN disclosed
CN-114174281-A Degradation agent for cyclin dependent kinase 7(CDK7) and use thereof 达纳-法伯癌症研究公司 2022-03-11 CN disclosed
CN-113956315-A Neuroactive steroids, compositions, and uses thereof 萨奇治疗股份有限公司 2022-01-21 CN disclosed
CN-107936076-B Neuroactive steroids, compositions, and uses thereof 萨奇治疗股份有限公司 2021-10-15 CN disclosed
CN-113234114-A 3, 3-disubstituted 19-norpregnane compounds, compositions, and uses thereof 萨奇治疗股份有限公司 2021-08-10 CN disclosed
CN-108976272-B 3, 3-disubstituted 19-norpregnane compounds, compositions, and uses thereof 萨奇治疗股份有限公司 2021-05-25 CN disclosed
CN-112312899-A Cancer therapy targeting cancer stem cells 治疗方案股份有限公司 2021-02-02 CN disclosed
CN-112057457-A Neuroactive steroids, compositions, and uses thereof 萨奇治疗股份有限公司 2020-12-11 CN disclosed
CN-111433211-A Synthesis of halichondrin 哈佛大学的校长及成员们 2020-07-17 CN disclosed
EP-0573182-B1 Process for extracting metal values AVECIA LTD (GB) 2000-01-05 EP disclosed
US-5728853-A AMIDO(BISTHIOPHOSHORYL) COMPOUNDS USEFUL FOR EXTRACTING METAL VALUES FROM AQUEOUS SOLUTIONS OF METAL SALTS ZENECA LIMITED (GB) 1998-03-17 US disclosed
US-5557003-A SOLVENT EXTRACTION OF ZINC FROM ORE ZENECA LIMITED (GB) 1996-09-17 US disclosed
US-5502250-A HYDROMETALLURGICAL PROCESS FOR EXTRACTING ZINC FROM ORE ZENECA LIMITED (GB) 1996-03-26 US disclosed
US-5433855-A Solvent extraction ZENECA LIMITED (GB) 1995-07-18 US disclosed
US-5393431-A Solvent extraction using a aminobis(thiophosphoryl) compound ZENECA LIMITED (GB) 1995-02-28 US disclosed
EP-0573182-A1 Process for extracting metal values ZENECA LIMITED (GB) 1993-12-08 EP disclosed