SCHEMBL6715480

SCHEMBL6715480

CCc1cccc(C)c1NNC(=O)C(N)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.48
PTGS2 P35354 2/20 0.47
P2RX7 Q99572 1/20 0.43
HTT P42858 3/20 0.43
POLB P06746 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
HSD17B10 Q99714 1/20 0.42
ALOX12 P18054 1/20 0.42
RAB9A P51151 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
NLRP3 Q96P20 1/20 0.40
LMNA P02545 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
CLCN2 P51788 1/20 0.39

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
SCHEMBL6727017 0.86 ALDH1A1 (0.59) ALDH1A1PTGS2HTTPOLBSMN1; SMN2
SCHEMBL6825248 0.83 ALDH1A1 (0.47) ALDH1A1PTGS2P2RX7HTTPOLB
SCHEMBL6715700 0.77 ALDH1A1 (0.43) ALDH1A1PTGS2P2RX7HTTPOLB
SCHEMBL6714089 0.77 ATM (0.55) ALDH1A1HTTPOLBSMN1; SMN2LMNA
SCHEMBL6715855 0.72 ALDH1A1 (0.58) ALDH1A1PTGS2HTTPOLBSMN1; SMN2
SCHEMBL11423763 0.72 NLRP3 (0.52) ALDH1A1PTGS2HTTPOLBSMN1; SMN2
SCHEMBL12812272 0.71 POLB (0.65) ALDH1A1PTGS2HTTPOLBSMN1; SMN2
SCHEMBL6715688 0.71 CXCL8 (0.51) PTGS2
SCHEMBL22169188 0.70 PTGS2 (0.51) ALDH1A1PTGS2HTTPOLBSMN1; SMN2
SCHEMBL6717218 0.70 MAPK1 (0.50) NLRP3LMNAMEN1KMT2A

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-20040152740-A1 Arylglycine derivatives for use as glycine transport inhibitors NPS ALLELIX CORPORATION (CA) 2004-08-05 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-20040152740-A1 Arylglycine derivatives for use as glycine transport inhibitors SLC1A2, SLC6A7, SLC1A1 ALDH1A1 572/4885PTGS2 1056/4885P2RX7 1776/4885

“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.