SCHEMBL13879527

SCHEMBL13879527

O=C1C2CCCN2C(=O)N1c1ccccc1Cl

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.57
AR P10275 2/20 0.55
TP53 P04637 1/20 0.51
KMT2A Q03164 1/20 0.50
MAPT P10636 3/20 0.48
GAA P10253 2/20 0.48
NPC1 O15118 1/20 0.48
POLB P06746 2/20 0.46
KDM4E B2RXH2 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
MGLL Q99685 1/20 0.44
HTT P42858 1/20 0.43
ALOX15 P16050 1/20 0.43
TSHR P16473 1/20 0.43
CASP1 P29466 1/20 0.43
HSD17B10 Q99714 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL13879486 0.96 ALDH1A1 (0.56) ALDH1A1ARTP53KMT2AMAPT
SCHEMBL5740144 0.81 LMNA (0.54) ALDH1A1ARKMT2AMAPTGAA
SCHEMBL5738288 0.80 AR (0.62) ALDH1A1ARKMT2AMAPTPOLB
SCHEMBL13879410 0.80 KDM4E (0.57) ALDH1A1ARKMT2AGAAPOLB
SCHEMBL5738846 0.80 AR (0.53) ALDH1A1ARKMT2AMAPTGAA
SCHEMBL5740339 0.78 KMT2A (0.72) ALDH1A1ARKMT2AGAAPOLB
SCHEMBL14547045 0.77 ALDH1A1 (0.71) ALDH1A1TP53MAPTGAANPC1
SCHEMBL1513976 0.77 ALDH1A1 (0.52) ALDH1A1ARKMT2AMAPTGAA
SCHEMBL13879455 0.76 KDM4E (0.56) ALDH1A1ARKMT2AGAAPOLB
SCHEMBL13879545 0.76 AR (0.60) ALDH1A1ARTP53KMT2APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090099186-A1 INHIBITORS OF VIRAL REPLICATION INTERMUNE, INC. 2009-04-16 US disclosed
US-20090099186-A1 INHIBITORS OF VIRAL REPLICATION INTERMUNE, INC. 2009-04-16 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-20090099186-A1 INHIBITORS OF VIRAL REPLICATION EIF2AK2, HAVCR2, RTF2 ALDH1A1 1500/4885AR 4274/4885TP53 1246/4885

“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.