SCHEMBL2816764

SCHEMBL2816764

CC(=O)Oc1ccc(Cc2nc(C(N)=O)c(NC(=O)Nc3cc(C(C)C)ccc3C)[nH]2)cc1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
NPSR1 Q6W5P4 1/20 0.40
MYOC Q99972 1/20 0.40
DDX3X O00571 1/20 0.38
NTRK1 P04629 1/20 0.35
PDE2A O00408 5/20 0.34
GAA P10253 1/20 0.33
MAPK1 P28482 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
RET P07949 1/20 0.33
GRIN1 Q05586 1/20 0.33
GRIN2B Q13224 1/20 0.33
TSPO P30536 1/20 0.33

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
SCHEMBL2814139 0.88 KMT2A (0.44) MAPTMEN1KMT2AGAASMN1; SMN2
SCHEMBL2816759 0.88 MAPT (0.51) MAPTMEN1KMT2ANPSR1MYOC
SCHEMBL13133013 0.87 MEN1 (0.43) MAPTMEN1KMT2ANPSR1MYOC
SCHEMBL2814969 0.86 FLT3 (0.43) MAPTMEN1KMT2ANTRK1GAA
SCHEMBL2813764 0.83 CCNC (0.39) MAPTMEN1KMT2ANPSR1NTRK1
SCHEMBL2813744 0.82 HRH3 (0.41) MAPTMEN1KMT2AGAASMN1; SMN2
SCHEMBL2816415 0.81 HRH3 (0.40) MAPTMEN1KMT2ANTRK1GAA
SCHEMBL2818220 0.80 SAE1 (0.42) MAPTMEN1KMT2AGAASMN1; SMN2
SCHEMBL2814136 0.80 KMT2A (0.42) MAPTMEN1KMT2ASMN1; SMN2RET
SCHEMBL2815380 0.79 MEN1 (0.57) MAPTMEN1KMT2ANTRK1PDE2A

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-20100249132-A1 IMIDAZOLE DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2010-09-30 US claimed
US-20100249132-A1 IMIDAZOLE DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2010-09-30 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-20100249132-A1 IMIDAZOLE DERIVATIVES SDHA, SDHB, TPD52L2 MAPT 3810/4885MEN1 171/4885KMT2A 1034/4885

“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.