SCHEMBL2816759

SCHEMBL2816759

Cc1ccc(C(C)C)cc1NC(=O)Nc1[nH]c(Cc2ccc(OCC(=O)O)cc2)nc1C(N)=O

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.51
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
NPSR1 Q6W5P4 1/20 0.39
MYOC Q99972 1/20 0.39
POLB P06746 1/20 0.38
DDX3X O00571 1/20 0.37
THRB P10828 3/20 0.36
GAA P10253 1/20 0.36
ALDH1A1 P00352 2/20 0.35
TSHR P16473 1/20 0.35
MAPK1 P28482 1/20 0.35
THRA P10827 2/20 0.35
BCHE P06276 1/20 0.34
ACHE P22303 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
NTRK1 P04629 1/20 0.34
LMNA P02545 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
SCHEMBL2816333 0.89 RAB9A (0.43) MAPTMEN1KMT2AALDH1A1TSHR
SCHEMBL2816764 0.88 MAPT (0.48) MAPTMEN1KMT2ANPSR1MYOC
SCHEMBL13133013 0.87 MEN1 (0.43) MAPTMEN1KMT2ANPSR1MYOC
SCHEMBL2814963 0.87 FLT3 (0.44) MAPTMEN1KMT2AGAAMAPK1
SCHEMBL2813760 0.83 MAPT (0.40) MAPTMEN1KMT2ANPSR1POLB
SCHEMBL2813738 0.83 HRH3 (0.44) MAPTMEN1KMT2ATHRBALDH1A1
SCHEMBL17957266 0.81 MAPT (0.43) MAPTMEN1KMT2APOLBALDH1A1
SCHEMBL2815561 0.81 MAPT (0.44) MAPTMEN1KMT2APOLBALDH1A1
SCHEMBL2815550 0.80 RAB9A (0.44) MAPTPOLBTHRBTSHRNPC1
SCHEMBL13132948 0.80 MAPT (0.43) MAPTMEN1KMT2APOLBALDH1A1

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 4 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
US-20100249132-A1 IMIDAZOLE DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2010-09-30 US disclosed
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.