SCHEMBL24417643

SCHEMBL24417643

Cn1nc(C(C)(C)C)c(C(C)(C)C)c1-c1ccccn1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.39
LMNA P02545 5/20 0.39
POLB P06746 2/20 0.39
BLM P54132 2/20 0.39
CCR1 P32246 2/20 0.39
CCR5 P51681 2/20 0.39
CCR8 P51685 2/20 0.39
METAP1 P53582 2/20 0.39
CYP1A2 P05177 1/20 0.39
HIF1A Q16665 1/20 0.39
DOHH Q9BU89 1/20 0.39
P4HTM Q9NXG6 1/20 0.39
NPC1 O15118 5/20 0.38
TP53 P04637 4/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
TSHR P16473 1/20 0.38
RAB9A P51151 3/20 0.37
HTT P42858 3/20 0.37
MAPT P10636 2/20 0.37
MAPK1 P28482 2/20 0.37

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
SCHEMBL24417641 0.77 POLB (0.41) KDM4EPOLBNPC1TSHRRAB9A
SCHEMBL13682914 0.73 P2RX7 (0.44) KDM4ELMNAPOLBBLMCCR1
SCHEMBL18944283 0.71 KDM4E (0.45) KDM4ELMNAPOLBBLMCCR1
SCHEMBL19652350 0.69 KDM4E (0.48) KDM4ELMNAPOLBBLMCCR1
SCHEMBL13184354 0.69 KDM4E (0.43) KDM4ELMNAPOLBBLMCCR1
SCHEMBL22952439 0.68 KDM4E (0.47) KDM4ELMNAPOLBBLMCCR1
SCHEMBL22304565 0.68 MAPK14 (0.39) MAPTKDM4CGRM5
SCHEMBL16200166 0.68 KDM4E (0.42) KDM4ELMNAPOLBBLMCCR1
SCHEMBL31221234 0.68 BRD4 (0.43) KDM4ELMNAPOLBBLMCCR1
SCHEMBL13727430 0.68 KDM4E (0.45) KDM4ELMNAPOLBBLMCCR1

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-20220143042-A1 FUSED GLYCOSIDASE INHIBITORS ASCENEURON SA (CH) 2022-05-12 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-20220143042-A1 FUSED GLYCOSIDASE INHIBITORS BACE1, ENGASE, GBA3 KDM4E 1953/4885LMNA 632/4885POLB 3216/4885

“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.