SCHEMBL5780650

SCHEMBL5780650

Ic1cc(C=NNc2ccc(-c3cccnc3)cc2)ccn1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.49
GAA P10253 8/20 0.49
SMN1; SMN2 Q16637 6/20 0.49
ALDH1A1 P00352 5/20 0.49
LMNA P02545 3/20 0.49
TDP1 Q9NUW8 3/20 0.49
GFER P55789 1/20 0.49
NPC1 O15118 9/20 0.48
RAB9A P51151 9/20 0.48
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
NPSR1 Q6W5P4 2/20 0.42
HSP90AA1 P07900 1/20 0.41
HDAC3 O15379 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC2 Q92769 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
KDM4E B2RXH2 1/20 0.39
POLB P06746 2/20 0.39
THRB P10828 1/20 0.39

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
SCHEMBL5775664 0.83 RAB9A (0.57) MAPTGAASMN1; SMN2ALDH1A1LMNA
SCHEMBL5773740 0.82 GAA (0.53) MAPTGAASMN1; SMN2ALDH1A1LMNA
SCHEMBL5773744 0.82 GAA (0.53) MAPTGAASMN1; SMN2ALDH1A1LMNA
SCHEMBL5779129 0.79 PTK2 (0.39) MAPTGAASMN1; SMN2ALDH1A1LMNA
SCHEMBL5778974 0.77 MAPT (0.45) MAPTGAASMN1; SMN2ALDH1A1LMNA
SCHEMBL5778977 0.77 MAPT (0.45) MAPTGAASMN1; SMN2ALDH1A1LMNA
SCHEMBL5778666 0.72 HDAC3 (0.42) MAPTGAASMN1; SMN2ALDH1A1LMNA
SCHEMBL5779669 0.71 RAB9A (0.49) MAPTGAASMN1; SMN2ALDH1A1NPC1
SCHEMBL15750396 0.70 CYP2A6 (0.58) MAPTSMN1; SMN2ALDH1A1LMNACYP1A2
SCHEMBL11486327 0.67 ALDH1A1 (0.74) MAPTGAASMN1; SMN2ALDH1A1LMNA

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-20060276433-A1 Hydrazone derivative DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2006-12-07 US disclosed
EP-1612204-A1 HYDRAZONE DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2006-01-04 EP 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-20060276433-A1 Hydrazone derivative APP, PRNP, HTT MAPT 94/4885GAA 3175/4885SMN1; SMN2 2146/4885

“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.