SCHEMBL6524718

SCHEMBL6524718

CCCCCCCCCCCCCCCCSCC(Nc1[nH]ccc1C)C(=O)O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ICMT O60725 1/20 0.37
MAPT P10636 2/20 0.36
GMNN O75496 1/20 0.36
TP53 P04637 1/20 0.36
POLB P06746 1/20 0.36
THRB P10828 1/20 0.36
CYP2C9 P11712 1/20 0.36
BLM P54132 1/20 0.36
HSD17B10 Q99714 1/20 0.36
PLA2G4B P0C869 4/20 0.34
S1PR1 P21453 3/20 0.34
S1PR3 Q99500 3/20 0.34
S1PR2 O95136 2/20 0.34
S1PR4 O95977 2/20 0.34
CES2 O00748 1/20 0.33
SOAT2 O75908 1/20 0.33
ACAT1 P24752 1/20 0.33
SOAT1 P35610 1/20 0.33
EPHX1 P07099 1/20 0.32
CYSLTR2 Q9NS75 1/20 0.32

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
SCHEMBL6526435 0.77 ICMT (0.38) ICMTMAPTGMNNTP53POLB
SCHEMBL12793162 0.76 FDPS (0.38) ICMTMAPTGMNNTP53POLB
SCHEMBL6523401 0.76 GMNN (0.36) ICMTMAPTGMNNTP53POLB
SCHEMBL6524319 0.74 FDPS (0.42) MAPTCYP2C9
SCHEMBL6524114 0.73 RAB9A (0.41) ICMTMAPTTP53HSD17B10ALDH1A1
SCHEMBL6521996 0.73 KDM4E (0.41) ICMTMAPTGMNNTP53POLB
SCHEMBL6526406 0.73 KDM6B (0.40) ICMTMAPTGMNNTP53POLB
SCHEMBL6520453 0.73 GMNN (0.40) ICMTMAPTGMNNTP53POLB
SCHEMBL6518242 0.72 ICMT (0.38) ICMTMAPTGMNNTP53POLB
SCHEMBL6522607 0.72 KDM4E (0.46) MAPTTP53CYP2C9ALDH1A1ITGB1

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-20110053901-A1 ACETYL MIMIC COMPOUNDS FOR THE INHIBITION OF ISOPRENYL-S-CYSTEINYL METHYLTRANSFERASE SIGNUM BIOSCIENCES, INC. (US) 2011-03-03 US disclosed
US-20110053901-A1 ACETYL MIMIC COMPOUNDS FOR THE INHIBITION OF ISOPRENYL-S-CYSTEINYL METHYLTRANSFERASE SIGNUM BIOSCIENCES, INC. (US) 2011-03-03 US disclosed
US-20110053901-A1 ACETYL MIMIC COMPOUNDS FOR THE INHIBITION OF ISOPRENYL-S-CYSTEINYL METHYLTRANSFERASE SIGNUM BIOSCIENCES, INC. (US) 2011-03-03 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-20110053901-A1 ACETYL MIMIC COMPOUNDS FOR THE INHIBITION OF ISOPRENYL-S-CYSTEINYL METHYLTRANSFERASE MPO, CYSLTR1, HNMT ICMT 326/4885MAPT 1682/4885GMNN 4376/4885

“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.