SCHEMBL4192236

SCHEMBL4192236

Cc1onc(-c2ccccc2)c1C(=O)NC(c1ccccc1)C1(N(C)C)CCCC1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.54
HTT P42858 2/20 0.49
TSHR P16473 1/20 0.49
SMN1; SMN2 Q16637 3/20 0.48
MAPK1 P28482 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
ALDH1A1 P00352 2/20 0.47
MEN1 O00255 2/20 0.47
GAA P10253 1/20 0.47
POLB P06746 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
TP53 P04637 1/20 0.47
GHSR Q92847 1/20 0.47
LMNA P02545 1/20 0.47
RAB9A P51151 1/20 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
SCHEMBL3230781 0.79 SLC6A9 (0.59) L3MBTL1
SCHEMBL13780494 0.79 SLC6A9 (0.59) L3MBTL1
SCHEMBL13501824 0.78 KMT2A (0.69) KMT2AHTTTSHRSMN1; SMN2MAPK1
SCHEMBL3236708 0.77 SLC6A9 (0.48) KMT2ASMN1; SMN2MEN1
SCHEMBL7893409 0.77 SLC6A9 (0.68)
SCHEMBL514434 0.77 SLC6A9 (0.55) KMT2AHTTTSHRSMN1; SMN2MAPK1
SCHEMBL3240614 0.75 SLC6A9 (0.56)
SCHEMBL3243915 0.75 SLC6A9 (0.47) CYP3A4CYP2C9CYP2C19ALDH1A1GAA
SCHEMBL3237783 0.75 SLC6A9 (0.47)
SCHEMBL3239398 0.74 SLC6A9 (0.55)

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-20090227629-A1 COMPOUNDS HAVING ACTIVITY AT THE GLYCINE TRANSPORTER GLYT1 AND USES THEREOF GLAXO GROUP LIMITED 2009-09-10 US claimed
US-20090227629-A1 COMPOUNDS HAVING ACTIVITY AT THE GLYCINE TRANSPORTER GLYT1 AND USES THEREOF GLAXO GROUP LIMITED 2009-09-10 US disclosed
US-20090227629-A1 COMPOUNDS HAVING ACTIVITY AT THE GLYCINE TRANSPORTER GLYT1 AND USES THEREOF GLAXO GROUP LIMITED 2009-09-10 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-20090227629-A1 COMPOUNDS HAVING ACTIVITY AT THE GLYCINE TRANSPORTER GLYT1 AND USES THEREOF SLC18A2, SLC6A3, SLC6A2 KMT2A 1191/4885HTT 223/4885TSHR 3248/4885

“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.