SCHEMBL3556570

SCHEMBL3556570

C[C@H](Nc1nc(-c2cnc3ccccn23)c2nc[nH]c2n1)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HSD17B10 Q99714 1/20 0.40
RPS6KB1 P23443 1/20 0.39
KIT P10721 1/20 0.37
IRAK4 Q9NWZ3 4/20 0.37
ATP1A1 P05023 4/20 0.37
ATP1B1 P05026 4/20 0.37
ATP1A3 P13637 4/20 0.37
ATP1B2 P14415 4/20 0.37
ATP1A2 P50993 4/20 0.37
ATP1B3 P54709 4/20 0.37
FXYD2 P54710 4/20 0.37
ATP1A4 Q13733 4/20 0.37
IGF1R P08069 4/20 0.37
CDK2 P24941 3/20 0.36
DYRK1A Q13627 1/20 0.35
PKM P14618 2/20 0.35
JUN P05412 1/20 0.35
MAPK8 P45983 1/20 0.35

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
SCHEMBL3551389 0.85 SMN1; SMN2 (0.38) LMNASMN1; SMN2HSD17B10RPS6KB1ATP1A1
SCHEMBL3548956 0.79 IGF1R (0.45) RPS6KB1KITIRAK4ATP1A1ATP1B1
SCHEMBL27711831 0.74 MEN1 (0.43) LMNASMN1; SMN2HSD17B10RPS6KB1ATP1A1
SCHEMBL3556311 0.74 DYRK1A (0.56) IRAK4IGF1RCDK2DYRK1AJUN
SCHEMBL1997497 0.70 IRAK4 (0.50) KITIRAK4ATP1A1ATP1B1ATP1A3
SCHEMBL1997500 0.70 IRAK4 (0.50) KITIRAK4ATP1A1ATP1B1ATP1A3
SCHEMBL3555067 0.68 BRD4 (0.44) ATP1A1ATP1B1ATP1A3ATP1B2ATP1A2
SCHEMBL3555366 0.67 IGF1R (0.41) RPS6KB1ATP1A1ATP1B1ATP1A3ATP1B2
SCHEMBL17933851 0.66 LMNA (0.50) LMNASMN1; SMN2HSD17B10CDK2
SCHEMBL14181331 0.66 LMNA (0.50) LMNASMN1; SMN2HSD17B10CDK2

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-7718801-B2 Substituted imidazole derivative BANYU PHARMACEUTICAL CO., LTD. (JP) 2010-05-18 US disclosed
US-20080070894-A1 Novel Substituted Imidazole Derivative MSD K.K. (JP) 2008-03-20 US disclosed
EP-1790650-A1 NOVEL SUBSTITUTED IMIDAZOLE DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 2007-05-30 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-20080070894-A1 Novel Substituted Imidazole Derivative PLK1, CDK1, CDK11A LMNA 2017/4885SMN1; SMN2 3452/4885HSD17B10 3515/4885

“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.