SCHEMBL6524196

SCHEMBL6524196

CCCCCCCCCCCCCCCCSCC(Nc1cc(F)ccn1)C(=O)O

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ICMT O60725 1/20 0.35
GPR84 Q9NQS5 1/20 0.35
PLA2G4B P0C869 2/20 0.34
MAPK14 Q16539 2/20 0.34
GMNN O75496 1/20 0.34
TP53 P04637 1/20 0.34
POLB P06746 1/20 0.34
MAPT P10636 1/20 0.34
THRB P10828 1/20 0.34
CYP2C9 P11712 1/20 0.34
BLM P54132 1/20 0.34
HSD17B10 Q99714 1/20 0.34
JAK2 O60674 1/20 0.33
KDM4E B2RXH2 1/20 0.33
HPGD P15428 1/20 0.33
ALDH1A1 P00352 1/20 0.33
ITGB1 P05556 1/20 0.33
ITGA4 P13612 1/20 0.33

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
SCHEMBL6522607 0.88 KDM4E (0.46) TP53MAPTCYP2C9KDM4EHPGD
SCHEMBL6527550 0.83 HCAR3 (0.38) ICMTPLA2G4BGMNNTP53POLB
SCHEMBL6521346 0.83 ALOX12 (0.47) POLBKDM4EALDH1A1
SCHEMBL6518242 0.81 ICMT (0.38) ICMTGPR84PLA2G4BGMNNTP53
SCHEMBL6520453 0.77 GMNN (0.40) ICMTGPR84PLA2G4BGMNNTP53
SCHEMBL6521996 0.77 KDM4E (0.41) ICMTPLA2G4BGMNNTP53POLB
SCHEMBL12793317 0.76 ITGB1 (0.48) POLBITGB1ITGA4
SCHEMBL6521511 0.76 GMNN (0.39) ICMTPLA2G4BGMNNTP53POLB
SCHEMBL3429743 0.76 FAAH (0.39) ICMTGPR84PLA2G4BGMNNTP53
SCHEMBL6524114 0.75 RAB9A (0.41) ICMTTP53MAPTHSD17B10ALDH1A1

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 326/4885GPR84 120/4885PLA2G4B 995/4885

“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.