SCHEMBL22198250

SCHEMBL22198250

CNc1ccc(/C=N/N=C/c2ccc(C)cc2)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.71
RAB9A P51151 3/20 0.71
SMN1; SMN2 Q16637 2/20 0.71
GRIN2D O15399 2/20 0.50
GRIN3B O60391 2/20 0.50
GRIN1 Q05586 2/20 0.50
GRIN2A Q12879 2/20 0.50
GRIN2B Q13224 2/20 0.50
GRIN2C Q14957 2/20 0.50
GRIN3A Q8TCU5 2/20 0.50
APP P05067 2/20 0.47
GAA P10253 2/20 0.43
RRM1 P23921 2/20 0.41
RRM2 P31350 1/20 0.41
RRM2B Q7LG56 1/20 0.41
ALDH1A1 P00352 2/20 0.41
MAPT P10636 1/20 0.41
CASP3 P42574 1/20 0.41
SENP8 Q96LD8 1/20 0.41
SENP7 Q9BQF6 1/20 0.41

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
SCHEMBL22198148 0.91 NPC1 (0.54) NPC1RAB9ASMN1; SMN2GRIN2DGRIN3B
SCHEMBL11743247 0.84 NPC1 (1.00) NPC1RAB9ASMN1; SMN2GRIN2DGRIN3B
SCHEMBL2608307 0.84 NPC1 (1.00) NPC1RAB9ASMN1; SMN2GRIN2DGRIN3B
SCHEMBL22198286 0.83 LMNA (0.62) NPC1RAB9ASMN1; SMN2GRIN2DGRIN3B
SCHEMBL22198264 0.82 APP (0.45) NPC1RAB9ASMN1; SMN2GRIN2DGRIN3B
SCHEMBL22198276 0.82 GRIN2D (0.48) NPC1RAB9ASMN1; SMN2GRIN2DGRIN3B
SCHEMBL22198267 0.82 ALDH1A1 (0.68) NPC1RAB9ASMN1; SMN2APPGAA
SCHEMBL22198265 0.82 NPC1 (0.48) NPC1RAB9ASMN1; SMN2APPGAA
SCHEMBL22198268 0.82 GRIN2D (0.48) NPC1RAB9ASMN1; SMN2GRIN2DGRIN3B
SCHEMBL14614215 0.80 APP (0.65) APP

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-20210393810-A1 DIHYDRAZONE COMPOUNDS HAVING HIGH AFFINITY TO A BETA PROTEIN AND TAU PROTEIN, DERIVATIVES THEREOF AND USE THEREOF HTA Co., Ltd. (CN) 2021-12-23 US disclosed
WO-2020140924-A1 DIHYDRAZONE COMPOUNDS HAVING HIGH AFFINITY TO AΒ PROTEIN AND TAU PROTEIN, DERIVATIVES THEREOF AND USE THEREOF 原子高科股份有限公司 2020-07-09 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-20210393810-A1 DIHYDRAZONE COMPOUNDS HAVING HIGH AFFINITY TO A BETA PROTEIN AND TAU PROTEIN, DERIVATIVES THEREOF AND USE THEREOF MAPT, APP, PSEN1 NPC1 2250/4885RAB9A 2536/4885SMN1; SMN2 2538/4885

“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.