SCHEMBL29829331

SCHEMBL29829331

c1coc(CNc2nccc3[nH]cnc23)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 8/20 0.55
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
TSHR P16473 3/20 0.55
HIF1A Q16665 2/20 0.55
TP53 P04637 1/20 0.55
CYP1A2 P05177 1/20 0.55
ADORA3 P0DMS8 1/20 0.55
ALOX15 P16050 1/20 0.55
KDR P35968 1/20 0.55
HSD17B10 Q99714 4/20 0.53
KDM4E B2RXH2 3/20 0.53
ALDH1A1 P00352 3/20 0.53
HPGD P15428 3/20 0.53
KDM4A O75164 1/20 0.48
KDM4B O94953 1/20 0.48
KDM5C P41229 1/20 0.48
KDM5B Q9UGL1 1/20 0.48
CCNB2 O95067 2/20 0.47
CDK1 P06493 2/20 0.47

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
SCHEMBL19064636 1.00 SMN1; SMN2 (0.55) SMN1; SMN2MEN1KMT2ATSHRHIF1A
SCHEMBL17009466 0.83 SMN1; SMN2 (0.49) SMN1; SMN2MEN1KMT2ATSHRHIF1A
Kinetin SCHEMBL29829493 0.81 SMN1; SMN2 (0.66) SMN1; SMN2MEN1KMT2ATSHRHIF1A
Kinetin SCHEMBL15705 0.81 SMN1; SMN2 (0.66) SMN1; SMN2MEN1KMT2ATSHRHIF1A
SCHEMBL4400404 0.78 UTS2R (0.55) TSHRCYP1A2KDM4EALDH1A1HPGD
SCHEMBL16146154 0.77 SMN1; SMN2 (0.52) SMN1; SMN2MEN1KMT2ATSHRHIF1A
SCHEMBL17009428 0.76 SMN1; SMN2 (0.50) SMN1; SMN2MEN1KMT2ATSHRHIF1A
SCHEMBL29830290 0.76 SMN1; SMN2 (0.50) SMN1; SMN2MEN1KMT2ATSHRHIF1A
SCHEMBL20119562 0.76 SMN1; SMN2 (0.50) SMN1; SMN2MEN1KMT2ATSHRHIF1A
SCHEMBL16147171 0.75 SMN1; SMN2 (0.52) SMN1; SMN2MEN1KMT2ATSHRHIF1A

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-20220274989-A9 Compositions and Methods of Using the Same for Treatment of Neurodegenerative and Mitochondrial Disease MITOKININ, INC. (US) 2022-09-01 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-20220274989-A9 Compositions and Methods of Using the Same for Treatment of Neurodegenerative and Mitochondrial Disease NLN, NME4, COQ8A SMN1; SMN2 106/4885MEN1 2209/4885KMT2A 3495/4885

“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.