SCHEMBL16293188

SCHEMBL16293188

CC(C)c1csc2nc(Cl)nc(N3CCC(CO)CC3)c12.Cc1sc2nc(Cl)nc(N3CCC(CO)CC3)c2c1C

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.39
KDM4E B2RXH2 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
MAPT P10636 2/20 0.38
HPGD P15428 4/20 0.38
LMNA P02545 4/20 0.38
ESR1 P03372 1/20 0.37
ALDH1A1 P00352 2/20 0.36
HTT P42858 1/20 0.36
CHRM4 P08173 3/20 0.36
NOD2 Q9HC29 1/20 0.35
ALOX15 P16050 1/20 0.35
TSHR P16473 1/20 0.35
STAT3 P40763 1/20 0.34

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
SCHEMBL28087461 0.91 ESR1 (0.43) SMN1; SMN2ESR1ALDH1A1
SCHEMBL16293189 0.88 HPGD (0.38) POLBKDM4EMEN1KMT2ASMN1; SMN2
SCHEMBL14964997 0.87 KDM4E (0.47) POLBKDM4EMEN1KMT2ASMN1; SMN2
SCHEMBL16293255 0.74 ESR1 (0.38) KDM4ESMN1; SMN2LMNAESR1HTT
SCHEMBL14965047 0.72 ALDH1A1 (0.55) POLBKDM4EKMT2ASMN1; SMN2ALDH1A1
SCHEMBL27978720 0.70 CHRM4 (0.47) POLBKDM4EMEN1KMT2ASMN1; SMN2
SCHEMBL16293796 0.69 KDM4E (0.44) POLBKDM4EMEN1KMT2ASMN1; SMN2
SCHEMBL14969468 0.64 STAT3 (0.44) MEN1KMT2ASTAT3
SCHEMBL16293285 0.63 MEN1 (0.48) KDM4EMEN1KMT2ASMN1; SMN2MAPT
SCHEMBL11202279 0.63 ESR1 (0.49) SMN1; SMN2ESR1ALDH1A1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160152634-A1 THIENO- AND FURO - PYRIMIDINES AND PYRIDINES, USEFUL AS POTASSIUM CHANNEL INHIBITORS XENTION LTD (GB) 2016-06-02 US disclosed
US-9290511-B2 Thieno-pyrimidines, useful as potassium channel inhibitors XENTION LIMITED (GB) 2016-03-22 US disclosed
US-20140371203-A1 Thieno- and furo - pyrimidines and pyridines, useful as potassium channel inhibitors XENTION LIMITED (GB) 2014-12-18 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 (2 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-20140371203-A1 Thieno- and furo - pyrimidines and pyridines, useful as potassium channel inhibitors KCNA3, KCNJ1, KCNJ11 POLB 3507/4885KDM4E 897/4885MEN1 1141/4885
US-20160152634-A1 THIENO- AND FURO - PYRIMIDINES AND PYRIDINES, USEFUL AS POTASSIUM CHANNEL INHIBITORS KCNA3, KCNJ1, KCNJ11 POLB 3644/4885KDM4E 809/4885MEN1 1205/4885

“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.