SCHEMBL4867468

SCHEMBL4867468

CC(C)C[C@H](NC(=O)c1ccccc1)C(=O)Cn1c(-c2ccccc2)noc1=O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.57
TSHR P16473 2/20 0.51
ALDH1A1 P00352 3/20 0.46
MAPT P10636 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
MEN1 O00255 1/20 0.46
USP2 O75604 1/20 0.46
ALOX15 P16050 1/20 0.46
HTT P42858 1/20 0.46
CTSL P07711 4/20 0.46
CTSB P07858 3/20 0.46
CTSK P43235 3/20 0.46
CTSS P25774 1/20 0.46
POLB P06746 1/20 0.43
CRHBP P24387 1/20 0.43
CRHR2 Q13324 1/20 0.43
CCR1 P32246 2/20 0.42
DGAT1 O75907 1/20 0.41
PSMB5 P28074 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
SCHEMBL4867859 0.94 KMT2A (0.52) KMT2ATSHRALDH1A1MAPTTDP1
SCHEMBL4868373 0.89 KMT2A (0.45) KMT2ATSHRTDP1L3MBTL1CTSL
SCHEMBL4864784 0.88 KMT2A (0.50) KMT2ATSHRALDH1A1CTSLCTSK
SCHEMBL4872595 0.86 GPR132 (0.51) KMT2ATSHRMAPTCTSK
SCHEMBL4870638 0.84 CTSS (0.47) KMT2ATSHRALDH1A1MEN1CTSL
SCHEMBL14158062 0.84 KMT2A (0.51) KMT2ATSHRALDH1A1MAPTTDP1
SCHEMBL14158331 0.84 KMT2A (0.51) KMT2ATSHRALDH1A1MAPTTDP1
SCHEMBL4866338 0.83 KMT2A (0.45) KMT2ATSHRALDH1A1MAPTTDP1
SCHEMBL4864503 0.83 KMT2A (0.45) KMT2ATSHRALDH1A1MAPTTDP1
SCHEMBL4870124 0.82 GPR132 (0.47) KMT2ATSHRALDH1A1MAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7390804-B2 N-containing five-membered ring compounds and pharmaceutical agents comprising the same as active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2008-06-24 US claimed
US-7390804-B2 N-containing five-membered ring compounds and pharmaceutical agents comprising the same as active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2008-06-24 US disclosed
US-7390804-B2 N-containing five-membered ring compounds and pharmaceutical agents comprising the same as active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2008-06-24 US disclosed
US-7390804-B2 N-containing five-membered ring compounds and pharmaceutical agents comprising the same as active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2008-06-24 US disclosed
US-20050164954-A1 N-containing five-membered ring compounds and pharmaceutical agents comprising the same as active ingredient ONO PHARMACEUTICAL CO., LTD. 2005-07-28 US disclosed
US-6900207-B2 N-containing five-membered ring compounds and pharmaceutical agents comprising the same as active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2005-05-31 US disclosed
US-20030153508-A1 Nitrogen-containing 5-membered cyclic compounds and drugs containing these compounds as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2003-08-14 US disclosed
EP-1254901-A1 NITROGEN-CONTAINING 5-MEMBERED CYCLIC COMPOUNDS AND DRUGS CONTAINING THESE COMPOUNDS AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2002-11-06 EP 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 (2 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-20050164954-A1 N-containing five-membered ring compounds and pharmaceutical agents comprising the same as active ingredient ACIN1, CASP7, CASP10 KMT2A 4568/4885TSHR 1500/4885ALDH1A1 3847/4885
US-20030153508-A1 Nitrogen-containing 5-membered cyclic compounds and drugs containing these compounds as the active ingredient ACIN1, CASP7, CASP10 KMT2A 4457/4885TSHR 1639/4885ALDH1A1 3366/4885

“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.