SCHEMBL13154997

SCHEMBL13154997

CC(=O)[C@H](Cc1cccnc1)NC=O

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ FDPS P14324 1/20 0.47
▸ PKM P14618 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ NAPRT Q6XQN6 1/20 0.44
▸ TBXAS1 P24557 5/20 0.44
▸ CYP1A2 P05177 2/20 0.44
▸ CYP2D6 P10635 1/20 0.44
▸ RECQL P46063 1/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ CYP2C9 P11712 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.42
▸ LMNA P02545 2/20 0.42
▸ ECE1 P42892 1/20 0.42
▸ NLRP3 Q96P20 1/20 0.42
▸ USP2 O75604 1/20 0.42

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
SCHEMBL12220088 0.84 TBXAS1 (0.50) FDPSPKMKMT2ANAPRTTBXAS1
SCHEMBL14898388 0.84 TBXAS1 (0.50) FDPSPKMKMT2ANAPRTTBXAS1
SCHEMBL13934329 0.84 TBXAS1 (0.50) FDPSPKMKMT2ANAPRTTBXAS1
SCHEMBL890153 0.82 CYP3A4 (0.41) KMT2ACYP1A2CYP3A4CYP2C9LMNA
SCHEMBL19042806 0.82 MEN1 (0.59) PKMKMT2ACYP1A2
SCHEMBL13827709 0.82 MEN1 (0.59) PKMKMT2ACYP1A2
SCHEMBL14537027 0.81 TBXAS1 (0.48) FDPSPKMKMT2ANAPRTTBXAS1
SCHEMBL22147478 0.81 TBXAS1 (0.48) FDPSPKMKMT2ANAPRTTBXAS1
SCHEMBL14864793 0.79 NLRP3 (0.48) FDPSPKMKMT2ANAPRTTBXAS1
SCHEMBL19072128 0.77 FDPS (0.56) FDPSPKMKMT2ANAPRTTBXAS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100260715-A1 HEPATITIS C VIRUS INHIBITORS ENANTA PHARMACEUTICALS, INC. 2010-10-14 — — 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-20100260715-A1 HEPATITIS C VIRUS INHIBITORS HAVCR2, SLC10A1, EIF2AK2 FDPS 331/4885PKM 2497/4885KMT2A 2957/4885

“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.

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