SCHEMBL165949

SCHEMBL165949

CCOC(=O)c1nc(Cl)c2cscc2n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.44
KMT2A Q03164 7/20 0.42
MEN1 O00255 6/20 0.42
MAPT P10636 5/20 0.41
GAA P10253 3/20 0.41
NPSR1 Q6W5P4 2/20 0.41
NPY1R P25929 1/20 0.41
NPY2R P49146 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
GPR55 Q9Y2T6 1/20 0.41
SCN9A Q15858 1/20 0.41
ALDH1A1 P00352 4/20 0.40
KDM4E B2RXH2 3/20 0.40
POLB P06746 2/20 0.40
HPGD P15428 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40

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
SCHEMBL166847 0.85 SMN1; SMN2 (0.46) SMN1; SMN2KMT2AMEN1MAPTGAA
SCHEMBL4751534 0.79 SMN1; SMN2 (0.40) SMN1; SMN2KMT2AMEN1MAPTGAA
SCHEMBL161315 0.78 SMN1; SMN2 (0.61) SMN1; SMN2KMT2AMEN1MAPTGAA
SCHEMBL7495667 0.76 KMT2A (0.54) SMN1; SMN2KMT2AMEN1MAPTGAA
SCHEMBL3287907 0.76 KDM4E (0.53) SMN1; SMN2KMT2AMEN1MAPTGAA
SCHEMBL164838 0.74 MAPT (0.45) SMN1; SMN2KMT2AMEN1MAPTGAA
SCHEMBL163775 0.74 KMT2A (0.42) SMN1; SMN2KMT2AMEN1MAPTGAA
SCHEMBL166288 0.74 TSHR (0.52) SMN1; SMN2KMT2AMEN1MAPTGAA
SCHEMBL163631 0.74 TSHR (0.52) SMN1; SMN2KMT2AMEN1MAPTGAA
SCHEMBL163006 0.74 KMT2A (0.42) SMN1; SMN2KMT2AMEN1MAPTGAA

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-20130317045-A1 THIENOPYRIDINE AND THIENOPYRIMIDINE COMPOUNDS AND METHODS OF USE THEREOF AMBIT BIOSCIENCES CORPORATION (US) 2013-11-28 US disclosed
EP-2611812-A1 THIENOPYRIDINE AND THIENOPYRIMIDINE COMPOUNDS AND METHODS OF USE THEREOF Ambit Biosciences Corporation (US) 2013-07-10 EP disclosed
WO-2012030894-A1 THIENOPYRIDINE AND THIENOPYRIMIDINE COMPOUNDS AND METHODS OF USE THEREOF AMBIT BIOSCIENCES CORPORATION (US) 2012-03-08 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-20130317045-A1 THIENOPYRIDINE AND THIENOPYRIMIDINE COMPOUNDS AND METHODS OF USE THEREOF JAK2, JAK3, TYK2 SMN1; SMN2 2249/4885KMT2A 1220/4885MEN1 3037/4885

“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.