SCHEMBL4501507

SCHEMBL4501507

[NH]C(=S)Nc1cnccn1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.46
KDM4E B2RXH2 7/20 0.44
RAB9A P51151 7/20 0.44
NPC1 O15118 5/20 0.44
SMN1; SMN2 Q16637 2/20 0.42
MAPT P10636 2/20 0.42
TSHR P16473 1/20 0.42
TP53 P04637 1/20 0.42
NFKB1 P19838 1/20 0.42
NFKB2 Q00653 1/20 0.42
RELA Q04206 1/20 0.42
ALDH1A1 P00352 1/20 0.42
BAZ2B Q9UIF8 1/20 0.41
POLB P06746 2/20 0.41
GAA P10253 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
SCHEMBL4208169 0.79 KMT2A (0.54) KMT2AKDM4ERAB9ANPC1SMN1; SMN2
SCHEMBL1889092 0.79 BAZ2B (0.50) KMT2AKDM4ERAB9ANPC1SMN1; SMN2
SCHEMBL4740932 0.79 KMT2A (0.46) KMT2AKDM4ERAB9ANPC1SMN1; SMN2
SCHEMBL28079721 0.75 KMT2A (0.50) KMT2AKDM4ERAB9ANPC1SMN1; SMN2
SCHEMBL11480120 0.75 KMT2A (0.46) KMT2AKDM4ERAB9ANPC1SMN1; SMN2
SCHEMBL15381202 0.75 RAB9A (0.47) KMT2AKDM4ERAB9ANPC1SMN1; SMN2
SCHEMBL8862850 0.75 CTH (0.50) KMT2AKDM4ERAB9ANPC1SMN1; SMN2
SCHEMBL5381046 0.74 KDM4E (0.69) KMT2AKDM4ERAB9ANPC1SMN1; SMN2
SCHEMBL4433427 0.73 KMT2A (0.45) KMT2AKDM4ERAB9ANPC1SMN1; SMN2
SCHEMBL1934753 0.72 RAB9A (0.57) KMT2AKDM4ERAB9ANPC1SMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090233960-A1 Kinase Inhibitors DEVGEN NV (BE) 2009-09-17 US disclosed
EP-1934181-A2 KINASE INHIBITORS Devgen NV (BE) 2008-06-25 EP disclosed
WO-2007042321-A2 KINASE INHIBITORS DEVGEN N.V. (BE) 2007-04-19 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-20090233960-A1 Kinase Inhibitors ROCK1, MAP3K1, MAP3K11 KMT2A 3194/4885KDM4E 4294/4885RAB9A 1324/4885

“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.