SCHEMBL16835348

SCHEMBL16835348

COc1ccc(S(=O)(=O)n2cc(C)c3cc(Cl)ccc32)cc1N1CCN(C(=O)C(Cl)(Cl)Cl)CC1

nearest known ligand 0.75

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ HTR6 P50406 19/20 0.75
▸ CYP3A4 P08684 2/20 0.56
▸ CYP2D6 P10635 1/20 0.56
▸ DRD2 P14416 1/20 0.56
▸ SLC6A2 P23975 1/20 0.56
▸ HTR2A P28223 1/20 0.56
▸ HTR2C P28335 1/20 0.56
▸ SLC6A4 P31645 1/20 0.56
▸ HTR7 P34969 1/20 0.56
▸ HRH1 P35367 1/20 0.56
▸ ADRA1B P35368 1/20 0.56
▸ SLC6A3 Q01959 1/20 0.56
▸ KCNH2 Q12809 1/20 0.56

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
SCHEMBL16835450 0.93 HTR6 (0.75) HTR6CYP3A4
SCHEMBL16835366 0.91 HTR6 (0.73) HTR6KCNH2
SCHEMBL18036682 0.91 HTR6 (0.73) HTR6
SCHEMBL18036642 0.89 HTR6 (0.59) HTR6CYP3A4
SCHEMBL18036661 0.88 HTR6 (0.77) HTR6CYP3A4
SCHEMBL16844432 0.86 HTR6 (0.81) HTR6CYP3A4CYP2D6DRD2SLC6A2
SCHEMBL16835451 0.86 HTR6 (1.00) HTR6CYP3A4CYP2D6DRD2SLC6A2
SCHEMBL18036686 0.85 HTR6 (0.73) HTR6CYP3A4
SCHEMBL16835456 0.85 HTR6 (0.73) HTR6CYP3A4KCNH2
SCHEMBL18053654 0.85 HTR6 (0.82) HTR6CYP3A4CYP2D6DRD2SLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3083588-B1 AROMATIC HETEROCYCLIC COMPOUNDS AND THEIR APPLICATION IN PHARMACEUTICALS SUNSHINE LAKE PHARMA CO LTD (CN) 2020-12-09 — — EP disclosed
US-9663498-B2 Aromatic heterocyclic compounds and their application in pharmaceuticals SUNSHINE LAKE PHARMA CO., LTD. (CN) 2017-05-30 — — US disclosed
EP-3083588-A1 AROMATIC HETEROCYCLIC COMPOUNDS AND THEIR APPLICATION IN PHARMACEUTICALS Sunshine Lake Pharma Co., Ltd. (CN) 2016-10-26 — — EP disclosed
US-20160251339-A1 AROMATIC HETEROCYCLIC COMPOUNDS AND THEIR APPLICATION IN PHARMACEUTICALS SUNSHINE LAKE PHARMA CO., LTD. (CN) 2016-09-01 — — US disclosed
WO-2015090233-A1 AROMATIC HETEROCYCLIC COMPOUNDS AND THEIR APPLICATION IN PHARMACEUTICALS SUNSHINE LAKE PHARMA CO., LTD. (CN) 2015-06-25 — — WO 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-20160251339-A1 AROMATIC HETEROCYCLIC COMPOUNDS AND THEIR APPLICATION IN PHARMACEUTICALS MAPT, APP, PSEN1 HTR6 294/4885CYP3A4 73/4885CYP2D6 101/4885

“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.

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