SCHEMBL4816664

SCHEMBL4816664

O=C(NC(CSCc1ccc(-c2ccc(-c3cccc4c3oc3ccccc34)cc2)cc1)C(=O)O)c1ccc(F)cc1F

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ICMT O60725 1/20 0.45
TDP1 Q9NUW8 1/20 0.44
C3AR1 Q16581 1/20 0.43
ACE P12821 2/20 0.41
FOLH1 Q04609 1/20 0.40
PPARA Q07869 1/20 0.39
FTO Q9C0B1 1/20 0.39
PSMB5 P28074 1/20 0.38
GGPS1 O95749 1/20 0.38
FNTA P49354 1/20 0.38
FNTB P49356 1/20 0.38
CTSB P07858 1/20 0.37
ALB P02768 1/20 0.37
IL2 P60568 1/20 0.37
CTSL P07711 1/20 0.36
BCL2L1 Q07817 1/20 0.36
ITGB2 P05107 1/20 0.36
ICAM1 P05362 1/20 0.36
ITGAL P20701 1/20 0.36
ALOX5 P09917 1/20 0.36

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
SCHEMBL3866478 1.00 ICMT (0.45) ICMTTDP1C3AR1ACEFOLH1
SCHEMBL3862177 0.91 C3AR1 (0.44) ICMTTDP1C3AR1ACEFOLH1
SCHEMBL4819544 0.91 C3AR1 (0.44) ICMTTDP1C3AR1ACEFOLH1
SCHEMBL3871838 0.91 ICMT (0.42) ICMTTDP1C3AR1ACEPPARA
SCHEMBL4821230 0.91 ICMT (0.42) ICMTTDP1C3AR1ACEPPARA
SCHEMBL3862214 0.88 TDP1 (0.46) ICMTTDP1C3AR1ACEFOLH1
SCHEMBL4819714 0.88 TDP1 (0.46) ICMTTDP1C3AR1ACEFOLH1
SCHEMBL3862107 0.87 TDP1 (0.54) ICMTTDP1C3AR1ACEFOLH1
SCHEMBL4816469 0.87 TDP1 (0.54) ICMTTDP1C3AR1ACEFOLH1
SCHEMBL3863000 0.87 ICMT (0.50) ICMTTDP1C3AR1ACEPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7358248-B2 Substituted amino carboxylic acids THE INSTITUTE FOR PHARMACEUTICAL DISCOVERY LLC (US) 2008-04-15 US claimed
US-20040266789-A1 Substituted amino carboxylic acids INSTITUTE FOR DIABETES DISCOVERY, L.L.C. 2004-12-30 US claimed
US-7358248-B2 Substituted amino carboxylic acids THE INSTITUTE FOR PHARMACEUTICAL DISCOVERY LLC (US) 2008-04-15 US disclosed
US-20040266789-A1 Substituted amino carboxylic acids INSTITUTE FOR DIABETES DISCOVERY, L.L.C. 2004-12-30 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-20040266789-A1 Substituted amino carboxylic acids PTPRS, PPM1B, PTPRO ICMT 4431/4885TDP1 744/4885C3AR1 3309/4885

“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.