SCHEMBL14965396

SCHEMBL14965396

CNC(=O)c1sc2ncnc(N3C4CCC3CC(NC3CCC3)C4)c2c1-c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GPR55 Q9Y2T6 1/20 0.38
OPRK1 P41145 1/20 0.37
BCAT2 O15382 1/20 0.37
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
SMN1; SMN2 Q16637 3/20 0.35
ALDH1A1 P00352 2/20 0.35
NPSR1 Q6W5P4 1/20 0.35
TP53 P04637 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
USP2 O75604 1/20 0.35
HPGD P15428 1/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL14965239 0.90 GPR55 (0.42) GPR55OPRK1MEN1KMT2ATP53
SCHEMBL14965464 0.79 TP53 (0.41) GPR55MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL14965298 0.78 MEN1 (0.39) MEN1KMT2ASMN1; SMN2ALDH1A1NPSR1
SCHEMBL14964931 0.77 GPR55 (0.45) GPR55MEN1KMT2AALDH1A1TP53
SCHEMBL14965367 0.77 SMN1; SMN2 (0.44) GPR55MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL16293147 0.75 LMNA (0.51) MEN1KMT2ASMN1; SMN2HPGDLMNA
SCHEMBL14965141 0.75 GPR55 (0.43) GPR55MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL14965004 0.74 MEN1 (0.41) MEN1KMT2ASMN1; SMN2ALDH1A1NPSR1
SCHEMBL14965159 0.74 TP53 (0.37) TP53RXFP1
SCHEMBL14965198 0.73 TP53 (0.37) TP53RXFP1HPGD

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
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
EP-2780343-A1 THIENO- AND FURO - PYRIMIDINES AND PYRIDINES, USEFUL AS POTASSIUM CHANNEL INHIBITORS Xention Limited (GB) 2014-09-24 EP disclosed
WO-2013072694-A1 THIENO- AND FURO - PYRIMIDINES AND PYRIDINES, USEFUL AS POTASSIUM CHANNEL INHIBITORS XENTION LIMITED (GB) 2013-05-23 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 (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 GPR55 1175/4885OPRK1 1173/4885BCAT2 2738/4885
US-20160152634-A1 THIENO- AND FURO - PYRIMIDINES AND PYRIDINES, USEFUL AS POTASSIUM CHANNEL INHIBITORS KCNA3, KCNJ1, KCNJ11 GPR55 1144/4885OPRK1 1141/4885BCAT2 2743/4885

“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.