SCHEMBL6911932

SCHEMBL6911932

Cc1ccc([S+]([O-])Cc2ccccc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.41
CYP2C19 P33261 1/20 0.41
LMNA P02545 2/20 0.40
POLB P06746 1/20 0.40
ACHE P22303 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
BCHE P06276 1/20 0.40
CA12 O43570 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
ATM Q13315 1/20 0.40
CA9 Q16790 1/20 0.40
ALOX12 P18054 2/20 0.39
TSHR P16473 1/20 0.39
CNR2 P34972 4/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MCHR1 Q99705 1/20 0.38
ALDH1A1 P00352 2/20 0.37
KDM4E B2RXH2 1/20 0.37
RAB9A P51151 1/20 0.37

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
SCHEMBL29285347 0.92 LMNA (0.40) HTTCYP2C19LMNAPOLBACHE
SCHEMBL13932518 0.90 IDO1 (0.41) ACHECYP1A2CA9ALDH1A1TDP1
SCHEMBL30047777 0.85 CALM1 (0.39) POLBCYP3A4ALOX12TSHRSMN1; SMN2
SCHEMBL28906945 0.85 CALM1 (0.39) POLBCYP3A4ALOX12TSHRSMN1; SMN2
SCHEMBL779948 0.85 CALM1 (0.39) POLBCYP3A4ALOX12TSHRSMN1; SMN2
SCHEMBL30047680 0.85 CALM1 (0.39) POLBCYP3A4ALOX12TSHRSMN1; SMN2
SCHEMBL7063604 0.81 L3MBTL1 (0.41) HTTCYP2C19LMNAPOLBACHE
SCHEMBL28468805 0.80 SIGMAR1 (0.41) HTTACHEL3MBTL1BCHECYP1A2
SCHEMBL28472082 0.80 ALDH1A1 (0.39) ACHEL3MBTL1BCHETSHRCNR2
SCHEMBL28462077 0.80 PLA2G1B (0.42) ACHECNR2ALDH1A1KDM4ERAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118580164-A Preparation method of sulfoxide derivative 华侨大学 2024-09-03 CN claimed
CN-118580164-A Preparation method of sulfoxide derivative 华侨大学 2024-09-03 CN disclosed
CN-118307453-A Synthesis method of alkylaryl sulfoxide 南京工业大学 2024-07-09 CN disclosed
WO-2021127337-A1 TRPML MODULATORS CASMA THERAPEUTICS, INC. (US) 2021-06-24 WO disclosed
CN-109485587-B Method for preparing sulfoxide compound by one-step reaction of benzyl chloride compound and thiophenol under metal-free condition 陕西师范大学 2020-10-16 CN disclosed
CN-110041236-A The synthetic method of thio-ether type compounds 天津师范大学 2019-07-23 CN disclosed
EP-2399584-A1 Boronic acids and esters as inhibitors of fatty acid amide hydrolase Infinity Pharmaceuticals, Inc. (US) 2011-12-28 EP disclosed
EP-2073816-B1 BORONIC ACIDS AND ESTERS AS INHIBITORS OF FATTY ACID AMIDE HYDROLASE INFINITY PHARMACEUTICALS INC (US) 2011-09-14 EP disclosed
US-20100069381-A1 GSK-3BETAINHIBITOR TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-03-18 US disclosed
US-6727294-B2 RADIATION TRANSPARENT MOLDING MATERIALS MITSUBISHI ENGINEERING-PLASTICS CORPORATION (JP) 2004-04-27 US disclosed
US-20010034419-A1 Radiation transparent molding materials MITSUBISHI ENGINEERING-PLASTICS CORPORATION (JP) 2001-10-25 US disclosed
US-4656290-A Process for preparing thio, dithio or carbonyl compounds CHINOIN GYOGYSZER ES VEGYESZETI TERMEKEK GYARA RT. (HU) 1987-04-07 US disclosed
EP-0150026-A2 Chemical process CHINOIN Gyogyszer és Vegyészeti Termékek Gyára RT. (HU) 1985-07-31 EP disclosed
US-4403054-A SULFOXIDE COMPOUND OR SULFINYL-CONTAINING POLYMER GENERAL ELECTRIC COMPANY (US) 1983-09-06 US 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 (1 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-20100069381-A1 GSK-3BETAINHIBITOR GSK3B, GSK3A, GSKIP HTT 3480/4885CYP2C19 854/4885LMNA 1441/4885

“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.