SCHEMBL16615637

SCHEMBL16615637

CCCc1c(C(=O)NCCc2ccccn2)cnn1-c1ccc(Cl)cc1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.52
MAPT P10636 5/20 0.52
GAA P10253 2/20 0.52
SMN1; SMN2 Q16637 1/20 0.50
KDM4E B2RXH2 2/20 0.49
HPGD P15428 1/20 0.49
CNR1 P21554 1/20 0.49
ALDH1A1 P00352 8/20 0.48
MAPK14 Q16539 3/20 0.48
MAPK1 P28482 4/20 0.48
LMNA P02545 1/20 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
SCHEMBL2854054 0.86 MAPT (0.57) POLBMAPTGAAALDH1A1MAPK14
SCHEMBL2858371 0.85 SMN1; SMN2 (0.48) POLBMAPTGAASMN1; SMN2KDM4E
SCHEMBL2853163 0.76 ALDH1A1 (0.45) POLBMAPTGAASMN1; SMN2ALDH1A1
SCHEMBL2858186 0.76 KMT2A (0.48) POLBMAPTGAAKDM4EALDH1A1
SCHEMBL2854295 0.76 MAPK14 (0.68) POLBMAPTGAAALDH1A1MAPK14
SCHEMBL2850360 0.75 MAPT (0.61) POLBMAPTGAAALDH1A1MAPK14
SCHEMBL2856280 0.75 MAPK14 (0.55) POLBMAPTGAAALDH1A1MAPK14
SCHEMBL2926984 0.75 P2RX7 (0.55) MAPTGAACNR1ALDH1A1MAPK14
SCHEMBL2079637 0.75 NR4A3 (0.59) POLBMAPTGAAHPGDALDH1A1
SCHEMBL1403169 0.75 MAPT (0.54) POLBMAPTGAASMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160213679-A1 INHIBITORS OF POLYNUCLEOTIDE REPEAT-ASSOCIATED RNA FOCI AND USES THEREOF Université de Montréal (CA) 2016-07-28 US disclosed
US-20160213679-A1 INHIBITORS OF POLYNUCLEOTIDE REPEAT-ASSOCIATED RNA FOCI AND USES THEREOF Université de Montréal (CA) 2016-07-28 US disclosed
WO-2015042685-A1 INHIBITORS OF POLYNUCLEOTIDE REPEAT-ASSOCIATED RNA FOCI AND USES THEREOF VALORISATION-RECHERCHE (CA) 2015-04-02 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-20160213679-A1 INHIBITORS OF POLYNUCLEOTIDE REPEAT-ASSOCIATED RNA FOCI AND USES THEREOF FBL, HNRNPA1, HNRNPUL1 POLB 128/4885MAPT 417/4885GAA 797/4885

“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.