SCHEMBL3602408

SCHEMBL3602408

N#Cc1ccc(NC(=O)Nc2ccccc2NC(=O)Cc2csc(N(Cc3ccncc3)C(=O)O)n2)cc1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
BLM P54132 1/20 0.43
ITGB1 P05556 2/20 0.43
ITGA4 P13612 2/20 0.43
MAPT P10636 3/20 0.43
GAA P10253 1/20 0.43
RORC P51449 1/20 0.42
LMNA P02545 3/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
NAMPT P43490 6/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
SAE1 Q9UBE0 1/20 0.40
UBA2 Q9UBT2 1/20 0.40
HTT P42858 2/20 0.40
ALDH1A1 P00352 1/20 0.40
TSHR P16473 1/20 0.40
PDE5A O76074 1/20 0.38
CDK5 Q00535 1/20 0.38
CDK5R1 Q15078 1/20 0.38

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
SCHEMBL5641924 0.87 BLM (0.40) BLMITGB1ITGA4MAPTGAA
SCHEMBL8244386 0.80 ITGB1 (0.48) BLMITGB1ITGA4MAPTGAA
SCHEMBL3607234 0.80 HDAC3 (0.45) MAPTGAALMNAMEN1KMT2A
SCHEMBL5601527 0.79 NAMPT (0.47) BLMITGB1ITGA4MAPTLMNA
SCHEMBL3601049 0.72 GSTO1 (0.48) MAPTGAALMNAHTTALDH1A1
SCHEMBL3602684 0.71 MMP13 (0.43) MAPTGAALMNAMEN1KMT2A
SCHEMBL3604443 0.68 MEN1 (0.41) MAPTGAALMNAMEN1KMT2A
SCHEMBL3600139 0.67 GSTO1 (0.52) MAPTGAALMNAMEN1KMT2A
SCHEMBL3602419 0.66 PDE5A (0.46) PDE5A
SCHEMBL3599789 0.66 MAPT (0.46) MAPTGAALMNAL3MBTL1HTT

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-20100152188-A1 Novel Heterocyclic Compounds ORCHID RESEARCH LABORATORIES LIMITED (IN) 2010-06-17 US claimed
US-20100152188-A1 Novel Heterocyclic Compounds ORCHID RESEARCH LABORATORIES LIMITED (IN) 2010-06-17 US disclosed
WO-2007017728-A2 NOVEL HETEROCYCLIC COMPOUNDS ORCHID RESEARCH LABORATORIES LIMITED (IN) 2007-02-15 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-20100152188-A1 Novel Heterocyclic Compounds CYP11B2, CYP3A5, CYP11B1 BLM 1409/4885ITGB1 4039/4885ITGA4 3761/4885

“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.