Sugi Predict

Sugi Predict / Compounds / SCHEMBL74267

SCHEMBL74267

SCHEMBL74267

CC(C)(C)N(Cc1ccccc1)C(C)(C)C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 3/20 0.54
▸ ALDH1A1 P00352 2/20 0.54
▸ AOC3 Q16853 1/20 0.50
▸ MEN1 O00255 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ HTT P42858 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ SLC6A2 P23975 2/20 0.44
▸ TAAR1 Q96RJ0 2/20 0.44
▸ RIPK1 Q13546 2/20 0.44
▸ NPC1 O15118 3/20 0.44
▸ RAB9A P51151 3/20 0.44
▸ CARM1 Q86X55 1/20 0.43
▸ PRMT6 Q96LA8 1/20 0.43
▸ PRMT8 Q9NR22 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ ADRA2B P18089 1/20 0.42
▸ ADRA2C P18825 1/20 0.42
▸ HTR2A P28223 1/20 0.42
▸ SLC6A4 P31645 1/20 0.42

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
SCHEMBL17278867 0.87 TAAR1 (0.61) TSHRALDH1A1HTTTAAR1LMNA
SCHEMBL22912454 0.82 AOC3 (0.50) AOC3TAAR1
SCHEMBL5425401 0.81 ALDH1A1 (0.50) TSHRALDH1A1AOC3MEN1KMT2A
SCHEMBL22912458 0.80 AOC3 (0.49) AOC3TAAR1
SCHEMBL21286459 0.80 TSHR (0.41) TSHRALDH1A1AOC3MEN1KMT2A
SCHEMBL5962473 0.80 TSHR (0.54) TSHRALDH1A1AOC3MEN1KMT2A
SCHEMBL9320590 0.79 RIPK1 (0.49) TSHRALDH1A1AOC3MEN1KMT2A
SCHEMBL608108 0.79 MEN1 (0.49) ALDH1A1MEN1KMT2AHTTL3MBTL1
SCHEMBL1640061 0.78 TSHR (0.58) TSHRALDH1A1AOC3MEN1KMT2A
SCHEMBL13941980 0.76 KCNH2 (0.46) TSHRL3MBTL1SLC6A2RAB9ACYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109503693-B Process for synthesizing Aramchol by using cholic acid as raw material 合肥工业大学 2021-04-06 — — CN claimed
CN-109503693-A A kind of new process efficiently synthesizing Aramchol for raw material using cholic acid and arachidic acid 合肥工业大学 2019-03-22 — — CN claimed
US-11324827-B2 Multifunctionalized polyethylene glycol derivative and preparation method therefor XIAMEN SINOPEG BIOTECH CO., LTD. (CN) 2022-05-10 — — US disclosed
US-11185853-B2 Catalysts for polycarbonate production SAUDI ARAMCO TECHNOLOGIES COMPANY (SA) 2021-11-30 — — US disclosed
CN-109503693-B Process for synthesizing Aramchol by using cholic acid as raw material 合肥工业大学 2021-04-06 — — CN disclosed
US-10662211-B2 Catalysts and methods for polymer synthesis Saurdi Aramco Technologies Company (SA) 2020-05-26 — — US disclosed
CN-110981933-A Method for efficiently synthesizing Aramchol 合肥工业大学 2020-04-10 — — CN disclosed
US-10464960-B2 Salen complexes with dianionic counterions SAUDI ARAMCO TECHNOLOGIES COMPANY (SA) 2019-11-05 — — US disclosed
US-20190193062-A1 CATALYSTS FOR POLYCARBONATE PRODUCTION ARAMCO PERFORMANCE MATERIALS LLC 2019-06-27 — — US disclosed
CN-109503693-A A kind of new process efficiently synthesizing Aramchol for raw material using cholic acid and arachidic acid 合肥工业大学 2019-03-22 — — CN disclosed
US-10221278-B2 Catalytic carbonylation catalysts and methods NOVOMER, INC. (US) 2019-03-05 — — US disclosed
US-20090240027-A1 INTERMEDIATES FOR MACROCYCLIC COMPOUNDS TRANZYME PHARMA INC. 2009-09-24 — — US disclosed
US-20090137835-A1 PROCESSES FOR INTERMEDIATES FOR MACROCYCLIC COMPOUNDS TRANZYME PHARMA INC. 2009-05-28 — — US disclosed
US-7521420-B2 Macrocyclic antagonists of the motilin receptor TRANZYME PHARMA, INC. (CA) 2009-04-21 — — US disclosed
US-5166435-A Hydrogenation with platinum catalyst of nitro compound in presence of nitrogen base and organophosphorus compound AKZO N.V. (NL) 1992-11-24 — — US disclosed
EP-0196484-B1 PRESSURE SENSITIVE MANIFOLD SHEET KANZAKI PAPER MANUFACTURING COMPANY LIMITED (JP) 1990-05-09 — — EP disclosed
EP-0147879-B1 PROCESS FOR THE PREPARATION OF A HYDROXYLAMINE AKZO N.V. (NL) 1987-12-16 — — EP disclosed
US-4704379-A Pressure sensitive manifold sheet KANZAKI PAPER MANUFACTURING CO. LTD. (JP) 1987-11-03 — — US disclosed
EP-0196484-A1 Pressure sensitive manifold sheet KANZAKI PAPER MANUFACTURING COMPANY LIMITED (JP) 1986-10-08 — — EP disclosed
EP-0147879-A1 Process for the preparation of a hydroxylamine AKZO N.V. (NL) 1985-07-10 — — EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10221278-B2 Catalytic carbonylation catalysts and methods CBR3, CBR1, EPHX2 TSHR 4642/4885ALDH1A1 181/4885AOC3 17/4885
US-20090137835-A1 PROCESSES FOR INTERMEDIATES FOR MACROCYCLIC COMPOUNDS MLNR, CHRM2, CHRM1 TSHR 74/4885ALDH1A1 2978/4885AOC3 1799/4885
US-10662211-B2 Catalysts and methods for polymer synthesis PPOX, COASY, SOD1 TSHR 4849/4885ALDH1A1 2255/4885AOC3 43/4885
US-10464960-B2 Salen complexes with dianionic counterions NCLN, POLN, NCL TSHR 4704/4885ALDH1A1 3519/4885AOC3 696/4885
US-20090240027-A1 INTERMEDIATES FOR MACROCYCLIC COMPOUNDS MLNR, CCKAR, CHRM2 TSHR 68/4885ALDH1A1 2729/4885AOC3 1664/4885
US-11324827-B2 Multifunctionalized polyethylene glycol derivative and preparation method therefor HDGF, F11, F12 TSHR 1973/4885ALDH1A1 1582/4885AOC3 4266/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.