SCHEMBL5446063

SCHEMBL5446063

COc1ccc(Cl)cc1NC(=O)Nc1nnc(C(=O)c2ccc(OC)c(OC)c2)s1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 9/20 0.50
▸ MEN1 O00255 7/20 0.50
▸ POLB P06746 4/20 0.50
▸ MAPT P10636 3/20 0.50
▸ TP53 P04637 1/20 0.50
▸ KDM4E B2RXH2 1/20 0.50
▸ NPC1 O15118 1/20 0.49
▸ RAB9A P51151 1/20 0.49
▸ ALDH1A1 P00352 2/20 0.47
▸ CYP1A2 P05177 1/20 0.47
▸ CYP2C19 P33261 1/20 0.47
▸ NTRK1 P04629 1/20 0.47
▸ IGF1R P08069 2/20 0.47
▸ CHEK1 O14757 1/20 0.45

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
SCHEMBL5441739 0.86 LMNA (0.61) KMT2AMEN1POLBMAPTKDM4E
SCHEMBL6371142 0.83 POLB (0.61) KMT2AMEN1POLBMAPTTP53
SCHEMBL5444512 0.81 MEN1 (0.49) KMT2AMEN1MAPTTP53KDM4E
SCHEMBL5441846 0.78 KMT2A (0.71) KMT2AMEN1MAPTNPC1RAB9A
SCHEMBL5435523 0.78 KMT2A (0.53) KMT2AMEN1POLBMAPTNPC1
SCHEMBL5444351 0.78 KMT2A (0.52) KMT2AMEN1POLBKDM4ENPC1
SCHEMBL5444881 0.78 MEN1 (0.48) KMT2AMEN1POLBNPC1RAB9A
SCHEMBL5441353 0.78 BLM (0.55) KMT2AMEN1MAPTRAB9A
SCHEMBL5448515 0.78 MEN1 (0.59) KMT2AMEN1KDM4ENPC1RAB9A
SCHEMBL5444917 0.78 HTR2A (0.46) KMT2AMEN1POLBMAPTTP53

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-20070191353-A1 Use of thiadiazoleurea derivatives MERCK PATENT GMBH (DE) 2007-08-16 — — US claimed
US-20070191353-A1 Use of thiadiazoleurea derivatives MERCK PATENT GMBH (DE) 2007-08-16 — — 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-20070191353-A1 Use of thiadiazoleurea derivatives RAF1, ARAF, JAK1 KMT2A 1865/4885MEN1 1756/4885POLB 4285/4885

“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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