SCHEMBL6782824

SCHEMBL6782824

COC(=O)C(CC(C)C)NC(=O)c1ccc(CNCc2c[nH]cn2)cc1-c1cccc2ccccc12

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FNTA P49354 12/20 0.62
FNTB P49356 10/20 0.62
PGGT1B P53609 9/20 0.62
TDP1 Q9NUW8 1/20 0.54
TAS1R3 Q7RTX0 6/20 0.44
TAS1R1 Q7RTX1 6/20 0.44
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
ICMT O60725 1/20 0.40

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
SCHEMBL6782826 1.00 FNTA (0.62) FNTAFNTBPGGT1BTDP1TAS1R3
SCHEMBL6774841 0.92 FNTA (0.73) FNTAFNTBPGGT1BTDP1
SCHEMBL10018886 0.89 FNTA (0.66) FNTAFNTBPGGT1BTDP1TAS1R3
SCHEMBL6777539 0.81 FNTA (0.60) FNTAFNTBPGGT1BTDP1TAS1R3
SCHEMBL6777543 0.81 FNTA (0.60) FNTAFNTBPGGT1BTDP1TAS1R3
SCHEMBL4280385 0.81 FNTA (0.78) FNTAFNTBPGGT1BTDP1
SCHEMBL20564402 0.80 FNTA (0.61) FNTAFNTBPGGT1BTDP1MEN1
SCHEMBL6775312 0.78 FNTA (0.59) FNTAFNTBPGGT1BTDP1TAS1R3
SCHEMBL6775315 0.78 FNTA (0.59) FNTAFNTBPGGT1BTDP1TAS1R3
SCHEMBL6776331 0.78 FNTA (0.75) FNTAFNTBICMT

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-20020193596-A1 Inhibitors of protein isoprenyl transferases UNIVERSITY OF PITTSBURGH (US) 2002-12-19 US claimed
US-6693123-B2 (4-(3-PYRIDYLAMINOMETHYLENE)-2-PHENYLBENZOYL)-N -METHYLMETHIONINE, METHYL ESTER FOR EXAMPLE; RESTENOSIS, HYPERPLASIA UNIVERSITY OF PITTSBURGH 2004-02-17 US disclosed
US-20020193596-A1 Inhibitors of protein isoprenyl transferases UNIVERSITY OF PITTSBURGH (US) 2002-12-19 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-20020193596-A1 Inhibitors of protein isoprenyl transferases LANCL1, FNTB, DHCR7 FNTA 20/4885FNTB 2/4885PGGT1B 1021/4885

“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.