SCHEMBL7758169

SCHEMBL7758169

Nc1nc(Nc2ccccc2)sc1-c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNA2 P20248 3/20 0.55
CDK2 P24941 3/20 0.55
MAPT P10636 8/20 0.54
MEN1 O00255 7/20 0.54
KMT2A Q03164 7/20 0.54
ALDH1A1 P00352 4/20 0.54
SMN1; SMN2 Q16637 3/20 0.54
MAPK1 P28482 2/20 0.54
HTT P42858 2/20 0.54
NPSR1 Q6W5P4 2/20 0.54
CYP2C9 P11712 2/20 0.54
CYP2C19 P33261 2/20 0.54
PKM P14618 1/20 0.54
CYP3A4 P08684 1/20 0.54
CYP2D6 P10635 1/20 0.54
ALOX15 P16050 1/20 0.54
POLB P06746 1/20 0.52
HPGD P15428 2/20 0.51
ALOX12 P18054 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51

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
SCHEMBL5724705 0.78 CCNA2 (0.78) CCNA2CDK2MAPTMEN1KMT2A
SCHEMBL19350384 0.77 MMP2 (0.55) CCNA2CDK2MAPTMEN1KMT2A
SCHEMBL5727092 0.76 CCNA2 (0.78) CCNA2CDK2MAPTMEN1KMT2A
SCHEMBL27659002 0.76 CDK11A (0.43) CCNA2CDK2MAPTALDH1A1SMN1; SMN2
SCHEMBL4908275 0.71 ALDH1A1 (0.71) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
Diphenylamine SCHEMBL6373876 0.71 ALOX12 (0.79) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL5725333 0.71 CCNA2 (1.00) CCNA2CDK2MAPTMEN1KMT2A
SCHEMBL30818066 0.70 MAPT (1.00) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL3490813 0.70 ALDH1A1 (1.00) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL9479463 0.70 ALOX12 (1.00) MAPTMEN1KMT2AALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20010039275-A1 Use of 2,4-diaminothiazole derivatives NOVO NORDISK A/S (DK) 2001-11-08 US disclosed
WO-2001056567-A1 2,4-DIAMINOTHIAZOLE DERIVATIVES AND THEIR USE AS GLYCOGEN SYNTHASE KINASE-3 (GSK-3) INHIBITORS NOVO NORDISK A/S (DK) 2001-08-09 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-20010039275-A1 Use of 2,4-diaminothiazole derivatives GSK3A, GSK3B, GSKIP CCNA2 3738/4885CDK2 566/4885MAPT 13/4885

“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.