SCHEMBL8424253

SCHEMBL8424253

CCNC(=O)Cc1csc(-c2ccc(Cl)cc2)n1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TP53 P04637 5/20 0.60
GFER P55789 1/20 0.55
SHMT2 P34897 4/20 0.54
SHMT1 P34896 3/20 0.54
KDM4E B2RXH2 1/20 0.53
THRB P10828 1/20 0.53
LMNA P02545 3/20 0.52
GAA P10253 2/20 0.52
ALDH1A1 P00352 1/20 0.52
MAPT P10636 2/20 0.52
RAB9A P51151 1/20 0.51
HPGD P15428 1/20 0.51
RHOC P08134 1/20 0.51
RHOA P61586 1/20 0.51

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
SCHEMBL8424602 0.86 KDM4E (0.71) TP53SHMT2SHMT1KDM4ELMNA
SCHEMBL21560039 0.86 SHMT2 (0.72) TP53GFERSHMT2SHMT1KDM4E
SCHEMBL8240059 0.84 SHMT1 (0.60) TP53GFERSHMT2SHMT1KDM4E
SCHEMBL21560017 0.84 GAA (0.71) TP53GFERSHMT2SHMT1KDM4E
SCHEMBL12608909 0.82 GFER (0.62) TP53GFERKDM4ETHRBLMNA
SCHEMBL12608910 0.82 TP53 (0.55) TP53GFERSHMT2SHMT1KDM4E
SCHEMBL27344271 0.81 ALDH1A1 (0.64) TP53GFERKDM4ETHRBLMNA
Fenclozic Acid SCHEMBL27104 0.80 LMNA (0.73) TP53GFERSHMT2SHMT1KDM4E
SCHEMBL21559996 0.80 SHMT1 (0.72) TP53GFERSHMT2SHMT1KDM4E
SCHEMBL20255618 0.80 SHMT1 (0.72) TP53GFERSHMT2SHMT1KDM4E

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-7335725-B2 Lipopeptides as antibacterial agents CUBIST PHARMACEUTICALS, INC. (US) 2008-02-26 US disclosed
US-20050203006-A1 Novel lipopeptides as antibacterial agents MERCK SHARP & DOHME CORP. 2005-09-15 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-20050203006-A1 Novel lipopeptides as antibacterial agents CLPTM1, NGLY1, VIP TP53 3685/4885GFER 1883/4885SHMT2 3771/4885

“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.