SCHEMBL25826152

SCHEMBL25826152

CNCC/C(=N\CN)c1cccc(OCC2CCCCC2)c1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 1/20 0.44
KAT6A Q92794 1/20 0.42
HPGD P15428 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
NR1H4 Q96RI1 1/20 0.40
PARP15 Q460N3 2/20 0.39
PARP10 Q53GL7 2/20 0.39
ADAM17 P78536 1/20 0.39
CARM1 Q86X55 1/20 0.39
PRMT6 Q96LA8 1/20 0.39
TLR4 O00206 1/20 0.38
TLR2 O60603 1/20 0.38

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
SCHEMBL20332000 0.82 KAT6A (0.46) SIRT2KAT6ANR1H4PARP15PARP10
SCHEMBL25818233 0.81 HPGD (0.46) SIRT2KAT6AHPGDRAB9ASMN1; SMN2
SCHEMBL18550944 0.81 KAT6A (0.45) SIRT2KAT6ANR1H4PARP15PARP10
SCHEMBL25817595 0.81 HPGD (0.51) SIRT2KAT6AHPGDRAB9ASMN1; SMN2
SCHEMBL2206291 0.81 HPGD (0.51) SIRT2KAT6AHPGDRAB9ASMN1; SMN2
SCHEMBL25825857 0.81 HPGD (0.46) SIRT2KAT6AHPGDRAB9ASMN1; SMN2
SCHEMBL19291614 0.80 NR1H4 (0.49) SIRT2KAT6AHPGDRAB9ASMN1; SMN2
SCHEMBL2208476 0.78 KAT6A (0.49) SIRT2KAT6ANR1H4PARP15PARP10
SCHEMBL4569102 0.78 KAT6A (0.49) SIRT2KAT6ANR1H4PARP15PARP10
SCHEMBL2208472 0.78 KAT6A (0.49) SIRT2KAT6ANR1H4PARP15PARP10

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-20230218549-A1 ALKOXY COMPOUNDS FOR DISEASE TREATMENT ACUCELA INC. 2023-07-13 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-20230218549-A1 ALKOXY COMPOUNDS FOR DISEASE TREATMENT ALDH1A2, CLN6, AGER SIRT2 903/4885KAT6A 1794/4885HPGD 110/4885

“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.