SCHEMBL5778130

SCHEMBL5778130

Cn1cncc1-c1ccc(NN)cc1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 4/20 0.46
HPGDS O60760 1/20 0.46
LDLR P01130 1/20 0.43
PCSK9 Q8NBP7 1/20 0.43
PRMT5 O14744 1/20 0.40
WDR77 Q9BQA1 1/20 0.40
RIPK2 O43353 1/20 0.39
GSK3B P49841 8/20 0.38
DYRK1A Q13627 8/20 0.38
WNT1 P04628 2/20 0.38
ICAM1 P05362 1/20 0.36
SELE P16581 1/20 0.36
MMP2 P08253 1/20 0.36
MMP13 P45452 1/20 0.36
MMP14 P50281 1/20 0.36
CHEK1 O14757 1/20 0.36

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
SCHEMBL22144037 0.84 IDO1 (0.47) IDO1HPGDSLDLRPCSK9PRMT5
SCHEMBL5779888 0.79 IDO1 (0.50) IDO1HPGDSLDLRPCSK9PRMT5
SCHEMBL1502339 0.77 IDO1 (0.51) IDO1HPGDSLDLRPCSK9PRMT5
SCHEMBL5779858 0.77 SMN1; SMN2 (0.55) IDO1GSK3BDYRK1AWNT1
SCHEMBL24185698 0.76 IDO1 (0.50) IDO1HPGDSLDLRPCSK9PRMT5
Ammonia Solution, Strong SCHEMBL28862527 0.76 IDO1 (0.50) IDO1HPGDSLDLRPCSK9PRMT5
SCHEMBL3452742 0.76 IDO1 (0.50) IDO1HPGDSLDLRPCSK9PRMT5
SCHEMBL10985317 0.76 IDO1 (0.53) IDO1HPGDSLDLRPCSK9PRMT5
SCHEMBL15875301 0.76 IDO1 (0.64) IDO1HPGDSLDLRPCSK9PRMT5
SCHEMBL27398874 0.76 IDO1 (0.50) IDO1HPGDSLDLRPCSK9PRMT5

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 IDO1 1988/4885HPGDS 741/4885LDLR 968/4885

“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.