SCHEMBL5712290

SCHEMBL5712290

CCCCC[S+]([O-])c1ccccn1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.39
HTT P42858 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
KDM4E B2RXH2 2/20 0.39
ALOX12 P18054 2/20 0.39
USP2 O75604 1/20 0.39
ALOX15 P16050 1/20 0.39
NPC1 O15118 1/20 0.39
HSP90AA1 P07900 1/20 0.39
RAB9A P51151 1/20 0.39
CYP1A2 P05177 2/20 0.38
CYP2C19 P33261 2/20 0.38
CYP2D6 P10635 1/20 0.38
CYP19A1 P11511 1/20 0.38
CYP2C9 P11712 1/20 0.38
HPGD P15428 1/20 0.34
KCNA5 P22460 1/20 0.33
KCNH2 Q12809 1/20 0.33

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
SCHEMBL11639333 0.95 CYP2D6 (0.39) LMNAHTTSMN1; SMN2KDM4EALOX12
SCHEMBL8778184 0.87 KCNA5 (0.36) LMNAHTTSMN1; SMN2KDM4EALOX12
SCHEMBL4685253 0.83 HDAC8 (0.32) LMNAKDM4ECYP1A2
SCHEMBL8629466 0.83 SMN1; SMN2 (0.31) LMNASMN1; SMN2KDM4ECYP1A2
SCHEMBL10972097 0.82 TDP1 (0.34) LMNAKDM4ENPC1RAB9ACYP1A2
SCHEMBL4697503 0.81 HDAC8 (0.31)
SCHEMBL4686082 0.81 HDAC8 (0.31)
SCHEMBL4697504 0.81 FLT3 (0.32) LMNAHTTSMN1; SMN2KDM4E
SCHEMBL4686084 0.81 FLT3 (0.32) LMNAHTTSMN1; SMN2KDM4E
SCHEMBL4681960 0.81 HDAC8 (0.33) LMNASMN1; SMN2KDM4ECYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114591228-B Chiral styryl pyridyl sulfoxide and synthesis method thereof 浙江大学杭州国际科创中心 2024-06-14 CN claimed
CN-114591228-B Chiral styryl pyridyl sulfoxide and synthesis method thereof 浙江大学杭州国际科创中心 2024-06-14 CN disclosed
CN-114591228-B Chiral styryl pyridyl sulfoxide and synthesis method thereof 浙江大学杭州国际科创中心 2024-06-14 CN disclosed
CN-114591228-A Chiral styryl pyridyl sulfoxide and synthesis method thereof 浙江大学杭州国际科创中心 2022-06-07 CN disclosed
CN-114591228-A Chiral styryl pyridyl sulfoxide and synthesis method thereof 浙江大学杭州国际科创中心 2022-06-07 CN disclosed
CN-104177390-A Preparation method for pyridyl boric acid UNIV CHINA PHARMA 2014-12-03 CN disclosed
EP-1288217-B1 Preparation of dialkylpyridylboranes PFIZER PROD INC (US) 2006-03-29 EP disclosed
US-6570017-B2 Reacting a Grigand reagent with borane compound PFIZER INC 2003-05-27 US disclosed
US-20030083312-A1 PREPARATION OF DIALKYLPYRIDYLBORANES PFIZER INC. 2003-05-01 US disclosed
CN-1401649-A Process for preparing dialkylpyridyl borane PFIZER PROD INC (US) 2003-03-12 CN disclosed
EP-1288217-A2 Preparation of dialkylpyridylboranes Pfizer Products Inc. (US) 2003-03-05 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 (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-20030083312-A1 PREPARATION OF DIALKYLPYRIDYLBORANES BMX, RDX, BRIX1 LMNA 1591/4885HTT 2335/4885SMN1; SMN2 4282/4885

“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.