SCHEMBL3246598

SCHEMBL3246598

CN(C)S(=O)(=O)CCc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.48
TAAR1 Q96RJ0 1/20 0.48
TSHR P16473 2/20 0.46
IDO1 P14902 1/20 0.46
AOC3 Q16853 2/20 0.45
POLB P06746 1/20 0.43
SIGMAR1 Q99720 1/20 0.42
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA7 P43166 1/20 0.42
CA13 Q8N1Q1 1/20 0.42
LMNA P02545 1/20 0.42
KMT2A Q03164 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
SCHEMBL30137215 0.82 KMT2A (0.46) CA2TAAR1POLBCA12CA1
SCHEMBL23395781 0.82 CA2 (0.47) CA2TAAR1IDO1AOC3POLB
SCHEMBL30137212 0.80 TAAR1 (0.52) CA2TAAR1AOC3SIGMAR1CA12
SCHEMBL4186854 0.80 RECQL (0.58) CA2TSHRSIGMAR1CA12CA1
SCHEMBL9368957 0.80 HPGD (0.33) CA2KMT2A
SCHEMBL30137220 0.80 TAAR1 (0.52) CA2TAAR1TSHRPOLBSIGMAR1
SCHEMBL30137226 0.80 AOC3 (0.48) CA2TAAR1AOC3SIGMAR1CA12
SCHEMBL30137216 0.80 ESR1 (0.48) CA2TAAR1SIGMAR1LMNAKMT2A
SCHEMBL3174757 0.78 HSP90AA1 (0.57) CA2TSHRAOC3CA1LMNA
SCHEMBL30137214 0.78 TAAR1 (0.57) TAAR1IDO1SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115611781-B New method for preparing alkyl sulfonamide from fatty amine sulfonyl chloride 天津师范大学 2024-03-26 CN disclosed
CN-115611781-A Novel method for preparing alkyl sulfonamide from fatty amine sulfonyl chloride 天津师范大学 2023-01-17 CN disclosed
US-10870657-B2 Compounds for the treatment of cancer and inflammatory disease SHY Therapeutics LLC (US) 2020-12-22 US disclosed
US-20190218229-A1 COMPOUNDS FOR THE TREATMENT OF CANCER AND INFLAMMTORY DISEASE SHY Therapeutics LLC 2019-07-18 US disclosed
EP-1167366-B1 AMINE DERIVATIVES DAIICHI SANKYO CO LTD (JP) 2010-05-05 EP disclosed
US-6562849-B1 Amine compound or pharmacologically acceptable salt thereof. These compounds are useful in the treatment and/or prophylaxis of diseases such as diabetes, hyperlipemia, arteriosclerosis, cancer, etc. SANKYO COMPANY, LIMITED (JP) 2003-05-13 US disclosed
US-20030078426-A1 Amine derivative compounds SANKYO COMPANY, LIMITED (JP) 2003-04-24 US disclosed
EP-1167366-A1 AMINE DERIVATIVES Sankyo Company, Limited (JP) 2002-01-02 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 (3 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-20190218229-A1 COMPOUNDS FOR THE TREATMENT OF CANCER AND INFLAMMTORY DISEASE MAPK1, MAPK6, MAP3K1 CA2 4462/4885TAAR1 2268/4885TSHR 4428/4885
US-10870657-B2 Compounds for the treatment of cancer and inflammatory disease MAPK6, MAP3K6, MAPK4 CA2 4222/4885TAAR1 3699/4885TSHR 4461/4885
US-20030078426-A1 Amine derivative compounds H1-10, APOB, PRMT1 CA2 1149/4885TAAR1 436/4885TSHR 2306/4885

“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.