SCHEMBL17422101

SCHEMBL17422101

Cc1ccc(S(=O)(=O)n2cc(C=O)c3c(N4CCN(C(=O)C(Cl)(Cl)Cl)CC4)cccc32)cc1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 16/20 0.50
KDM4E B2RXH2 1/20 0.49
UBE2N P61088 1/20 0.49
HTR2C P28335 2/20 0.44
HTR1D P28221 1/20 0.40
HTR1B P28222 1/20 0.40
DRD3 P35462 1/20 0.40
ALOX5 P09917 1/20 0.40
HTR2A P28223 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
HTT P42858 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
SCHEMBL18690941 0.92 HTR6 (0.48) HTR6KDM4EUBE2NHTR2CHTR2A
SCHEMBL17422096 0.90 HTR6 (0.52) HTR6KDM4EUBE2NHTR2CHTR2A
SCHEMBL2229621 0.89 KDM4E (0.53) HTR6KDM4EUBE2NHTR2CHTR1D
SCHEMBL17422025 0.86 HTR6 (0.52) HTR6HTR2CDRD3HTR2A
SCHEMBL17422051 0.86 HTR6 (0.56) HTR6
SCHEMBL2230089 0.86 KDM4E (0.48) HTR6KDM4EUBE2NHTR2CHTR1D
SCHEMBL17422123 0.85 HTR6 (0.54) HTR6HTR2C
SCHEMBL18690903 0.84 HTR6 (0.72) HTR6HTR2C
SCHEMBL31298699 0.84 KDM4E (0.59) HTR6KDM4EUBE2NHTR2CHTR1D
SCHEMBL17422129 0.83 HTR6 (0.52) HTR6HTR2CDRD3HTR2AALDH1A1

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-3166924-B1 AROMATIC HETEROCYCLIC DERIVATIVES AND PHARMACEUTICAL APPLICATIONS THEREOF SUNSHINE LAKE PHARMA CO LTD (CN) 2019-02-20 EP disclosed
US-9974785-B2 Aromatic heterocyclic derivatives and pharmaceutical applications thereof SUNSHINE LAKE PHARMA CO., LTD. (CN) 2018-05-22 US disclosed
EP-3166924-A1 AROMATIC HETEROCYCLIC DERIVATIVES AND PHARMACEUTICAL APPLICATIONS THEREOF Sunshine Lake Pharma Co., Ltd. (CN) 2017-05-17 EP disclosed
US-20170096392-A1 AROMATIC HETEROCYCLIC DERIVATIVES AND PHARMACEUTICAL APPLICATIONS THEREOF SUNSHINE LAKE PHARMA CO., LTD. (CN) 2017-04-06 US disclosed
WO-2016004882-A1 AROMATIC HETEROCYCLIC DERIVATIVES AND PHARMACEUTICAL APPLICATIONS THEREOF SUNSHINE LAKE PHARMA CO., LTD. (CN) 2016-01-14 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-20170096392-A1 AROMATIC HETEROCYCLIC DERIVATIVES AND PHARMACEUTICAL APPLICATIONS THEREOF HTR6, HTR3A, HTR5A HTR6 1/4885KDM4E 3544/4885UBE2N 2993/4885

“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.