SCHEMBL7726344

SCHEMBL7726344

CCCCn1ccc(-c2cc(Br)ccc2OC)c(NC(=O)Nc2c(SC)cc(C)nc2SC)c1=O

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SOAT1 P35610 6/20 0.35
GRM2 Q14416 3/20 0.35
BRD9 Q9H8M2 2/20 0.35
TNF P01375 2/20 0.33
KMT2A Q03164 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
MEN1 O00255 1/20 0.33
MAPK1 P28482 1/20 0.33
GRK6 P43250 1/20 0.33
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL7734588 0.92 GRM2 (0.38) SOAT1GRM2BRD9TNFKMT2A
SCHEMBL7738806 0.91 GRM2 (0.38) SOAT1GRM2BRD9TNFALDH1A1
SCHEMBL7738006 0.90 SOAT1 (0.39) SOAT1GRM2TNFKMT2AMEN1
SCHEMBL7726027 0.90 SOAT1 (0.36) SOAT1GRM2TNFKMT2ASMN1; SMN2
SCHEMBL7734403 0.86 GRM2 (0.37) SOAT1GRM2ALDH1A1
SCHEMBL7734469 0.83 SOAT1 (0.36) SOAT1GRM2
SCHEMBL7737837 0.83 SOAT1 (0.35) SOAT1GRM2KMT2AMEN1
SCHEMBL7726041 0.78 LPAR1 (0.53)
SCHEMBL7735770 0.76 SOAT1 (0.35) SOAT1GRM2KMT2ASMN1; SMN2MEN1
SCHEMBL7735771 0.74 GRM2 (0.37) SOAT1GRM2

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-6452008-B2 3-UREA COMPOUND FROM THE 3-AMIDO COMPOUND WITHOUT AZIDATION PROCESS WHICH HAS RISK OF EXPLOSION; REACTION WITH HYPOCHLORITE, HYPOBROMITE OR LEAD TETRAACETATE AND THEN AN AMINE; ACAT INHIBITOR SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2002-09-17 US disclosed
US-20010051732-A1 Pyridone derivatives and process for preparing the same SUMITOMO PHARMACEUTICALS COMPANY, LIMITED 2001-12-13 US disclosed
US-6300500-B1 Preparation of pyridone derivatives using phthalimido containing starting material SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2001-10-09 US disclosed
EP-1086948-A1 PYRIDONE DERIVATIVES AND PROCESS FOR PRODUCING THE SAME SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2001-03-28 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 (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-20010051732-A1 Pyridone derivatives and process for preparing the same HK1, HPD, ALK SOAT1 2578/4885GRM2 3251/4885BRD9 1513/4885

“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.