SCHEMBL2655938

SCHEMBL2655938

CCN(Cc1ccc(C(=O)NCc2noc(=O)[nH]2)cc1)C(=O)OC(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ HDAC1 Q13547 4/20 0.46
▸ HDAC3 O15379 2/20 0.46
▸ HDAC2 Q92769 2/20 0.46
▸ NCOR2 Q9Y618 2/20 0.46
▸ EPHX2 P34913 5/20 0.36
▸ NR1H4 Q96RI1 4/20 0.36
▸ HDAC6 Q9UBN7 2/20 0.36
▸ PLA2G2A P14555 6/20 0.36
▸ LSS P48449 1/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ HTT P42858 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ MEN1 O00255 3/20 0.35
▸ KMT2A Q03164 3/20 0.35
▸ CYP2C19 P33261 2/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ NPC1 O15118 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL2651344 0.88 LSS (0.39) HDAC1HDAC3HDAC2NCOR2EPHX2
SCHEMBL2651773 0.83 EPHX2 (0.41) HDAC3EPHX2NR1H4HDAC6MEN1
SCHEMBL2655940 0.76 PLA2G2A (0.42) HDAC1HDAC3EPHX2NR1H4HDAC6
SCHEMBL2656900 0.76 HDAC1 (0.50) HDAC1HDAC3HDAC2NCOR2EPHX2
SCHEMBL2651609 0.76 PLA2G2A (0.44) HDAC1HDAC3EPHX2NR1H4HDAC6
SCHEMBL2655927 0.75 HDAC1 (0.54) HDAC1HDAC3HDAC2NCOR2EPHX2
SCHEMBL2652198 0.74 LSS (0.38) HDAC1EPHX2NR1H4HDAC6PLA2G2A
SCHEMBL2644845 0.73 CA1 (0.53) HDAC3EPHX2NR1H4HDAC6MEN1
Hydrochloric Acid SCHEMBL2644250 0.72 CA1 (0.52) HDAC3EPHX2NR1H4HDAC6MEN1
SCHEMBL2655936 0.72 HDAC1 (0.54) HDAC1HDAC3HDAC2NCOR2HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030203946-A1 Glucagon antagonists/inverse agonists NOVO NORDISK A/S (DK) 2003-10-30 — — US disclosed
WO-2002040445-A1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK A/S (DK) 2002-05-23 — — WO 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-20030203946-A1 Glucagon antagonists/inverse agonists GLP1R, GPR119, GCGR HDAC1 2196/4885HDAC3 1032/4885HDAC2 2516/4885

“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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