Sugi Predict

Sugi Predict / Compounds / SCHEMBL9841232

SCHEMBL9841232

SCHEMBL9841232

CC(CBr)CCOCc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 1/20 0.50
▸ TDP1 Q9NUW8 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ CYP2C19 P33261 1/20 0.40
▸ NAAA Q02083 1/20 0.40
▸ CA1 P00915 3/20 0.40
▸ CA2 P00918 2/20 0.40
▸ CA7 P43166 2/20 0.40
▸ CA9 Q16790 2/20 0.40
▸ HTT P42858 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ MPO P05164 1/20 0.39
▸ TPO P07202 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ TACR1 P25103 2/20 0.39

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
SCHEMBL9841231 1.00 TSHR (0.50) TSHRTDP1L3MBTL1CYP2C19NAAA
SCHEMBL10911338 1.00 TSHR (0.50) TSHRTDP1L3MBTL1CYP2C19NAAA
SCHEMBL6942348 0.89 TSHR (0.47) TSHRTDP1L3MBTL1CYP2C19NAAA
SCHEMBL27622932 0.89 TSHR (0.47) TSHRTDP1L3MBTL1NAAACA1
SCHEMBL27622935 0.89 TSHR (0.47) TSHRTDP1L3MBTL1NAAACA1
SCHEMBL13246484 0.85 TSHR (0.50) TSHRTDP1L3MBTL1CYP2C19CA1
SCHEMBL14402703 0.84 TSHR (0.48) TSHRTDP1L3MBTL1CYP2C19NAAA
SCHEMBL20207392 0.84 TSHR (0.48) TSHRTDP1L3MBTL1CYP2C19NAAA
SCHEMBL9510653 0.84 TSHR (0.48) TSHRTDP1L3MBTL1CYP2C19NAAA
SCHEMBL11121387 0.84 TSHR (0.48) TSHRTDP1L3MBTL1CYP2C19NAAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110218231-B Cyclobutane dicarboxylic acid platinum complex, intermediate thereof, preparation method thereof, pharmaceutical composition and application thereof 天津谷堆生物医药科技有限公司 2023-03-24 — — CN disclosed
CN-102786393-A Synthetic method of (R)-4-benzyloxy-1-bromine-2-methylbutane in dolichol biological chain INST CHEM IND FOREST PROD CAF 2012-11-21 — — CN disclosed
CN-102775281-A Synthesis method of 4-benzyloxy-2-methyl-1-butylene in dolichol biologic chains INST CHEM IND FOREST PROD CAF 2012-11-14 — — CN disclosed
CN-102775283-A Synthesis method of (R,S)-4-benzyloxy-2-methyl-1-butanol in dolichol biological chain INST CHEM IND FOREST PROD CAF 2012-11-14 — — CN disclosed
CN-102766673-A Synthetic method of (R)-4-benzyloxy-2-methyl-1-butyl alcohol in dolichol biological chain INST CHEM IND FOREST PROD CAF 2012-11-07 — — CN disclosed
US-5077046-A Plant extracts; mannaliam dolichols intermediates KURARAY CO., LTD. (JP) 1991-12-31 — — US disclosed
US-5012018-A Extending polyisoprene chain using copper catalyst KURARAY CO., LTD. (JP) 1991-04-30 — — US disclosed
US-4886904-A CONTAINING CIS AND TRANS ISOPRENE UNITS KURARAY CO., LTD. (JP) 1989-12-12 — — US disclosed
US-4603208-A MODIFIED POLYISOPRENE CONVERTED TO DOLICHOLS KURARAY CO., LTD. (JP) 1986-07-29 — — US disclosed
EP-0054753-B1 POLYPRENYL COMPOSITION OR COMPOUNDS AND PROCESS FOR THE PRODUCTION THEREOF KURARAY CO., LTD. (JP) 1985-07-24 — — EP disclosed
EP-0087638-B1 POLYPRENYL COMPOUNDS AND PREPARATION THEREOF KURARAY CO., LTD. (JP) 1985-06-05 — — EP disclosed
EP-0087638-A1 Polyprenyl compounds and preparation thereof KURARAY CO., LTD. (JP) 1983-09-07 — — EP disclosed
EP-0054753-A1 Polyprenyl composition or compounds and process for the production thereof KURARAY CO., LTD. (JP) 1982-06-30 — — EP disclosed