SCHEMBL24706996

SCHEMBL24706996

N#CC(C#N)=NNc1nc2ccc(-c3ccccc3)cc2s1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIK3CG P48736 3/20 0.55
▸ ABL1 P00519 2/20 0.50
▸ PIK3CA P42336 2/20 0.48
▸ PI4KA P42356 1/20 0.48
▸ PI4KB Q9UBF8 1/20 0.48
▸ OTUD7B Q6GQQ9 1/20 0.47
▸ LIPG Q9Y5X9 7/20 0.47
▸ MAP4K4 O95819 2/20 0.46
▸ PRKCG P05129 2/20 0.46
▸ PRKACA P17612 2/20 0.46
▸ RPS6KB1 P23443 2/20 0.46
▸ AKT1 P31749 2/20 0.46
▸ CSNK1D P48730 2/20 0.46
▸ CLK2 P49760 2/20 0.46
▸ IRAK1 P51617 2/20 0.46
▸ PRKX P51817 2/20 0.46
▸ NEK4 P51957 2/20 0.46
▸ PRKCD Q05655 2/20 0.46
▸ ROCK1 Q13464 2/20 0.46
▸ DYRK1A Q13627 2/20 0.46

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
SCHEMBL922531 0.83 HSP90AA1 (0.57) DYRK1AMAPK1HSP90AA1
SCHEMBL24707371 0.82 MAPT (0.51) SCD
SCHEMBL24707000 0.81 MAPT (0.55) DYRK1AMAPK1
SCHEMBL24707315 0.81 SMN1; SMN2 (0.55) DYRK1A
SCHEMBL24706384 0.81 RAB9A (0.52) DYRK1AHSP90AA1
SCHEMBL24705959 0.81 DYRK1A (0.53) CSNK1DDYRK1A
SCHEMBL24706377 0.78 SMN1; SMN2 (0.51) —
SCHEMBL24707370 0.78 DYRK1A (0.55) CSNK1DDYRK1A
SCHEMBL923102 0.78 NPC1 (0.56) CSNK1DDYRK1AMAPK1SCD
SCHEMBL24706983 0.75 GAA (0.44) DYRK1AMAPK1HSP90AA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220396553-A1 NOVEL HYDRAZONE DERIVATIVE IN WHICH TERMINAL AMINE GROUP IS SUBSTITUTED WITH ARYL GROUP OR HETEROARYL GROUP, AND USE THEREOF KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2022-12-15 — — US 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-20220396553-A1 NOVEL HYDRAZONE DERIVATIVE IN WHICH TERMINAL AMINE GROUP IS SUBSTITUTED WITH ARYL GROUP OR HETEROARYL GROUP, AND USE THEREOF AANAT, NAT1, HNMT PIK3CG 3783/4885ABL1 200/4885PIK3CA 4363/4885

“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.

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