SCHEMBL855316

SCHEMBL855316

Cc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)Nc2c(C(C)C)cccc2C(C)C)cc1C

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SOAT2 O75908 1/20 0.44
ACAT1 P24752 1/20 0.44
SOAT1 P35610 1/20 0.44
NR1H4 Q96RI1 2/20 0.43
LMNA P02545 3/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
ALDH1A1 P00352 2/20 0.41
MAPK1 P28482 1/20 0.41
SIRT5 Q9NXA8 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
MAPT P10636 1/20 0.39

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
SCHEMBL855709 0.90 SOAT2 (0.50) SOAT2ACAT1SOAT1NR1H4LMNA
SCHEMBL854439 0.88 SOAT2 (0.47) SOAT2ACAT1SOAT1NR1H4ALDH1A1
SCHEMBL855989 0.87 NR1H4 (0.46) SOAT2ACAT1SOAT1NR1H4SMN1; SMN2
SCHEMBL855984 0.86 SOAT2 (0.47) SOAT2ACAT1SOAT1NR1H4LMNA
SCHEMBL855945 0.85 SOAT2 (0.47) SOAT2ACAT1SOAT1NR1H4LMNA
SCHEMBL854758 0.85 SOAT2 (0.47) SOAT2ACAT1SOAT1NR1H4SMN1; SMN2
SCHEMBL854639 0.84 SOAT2 (0.46) SOAT2ACAT1SOAT1NR1H4LMNA
SCHEMBL856052 0.84 SOAT2 (0.46) SOAT2ACAT1SOAT1NR1H4SMN1; SMN2
SCHEMBL855915 0.84 SOAT2 (0.46) SOAT2ACAT1SOAT1NR1H4ALDH1A1
SCHEMBL855452 0.84 SOAT2 (0.46) SOAT2ACAT1SOAT1NR1H4SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1308438-B9 3-SUBSTITUTED UREA DERIVATIVES AND MEDICINAL USE THEREOF MITSUBISHI TANABE PHARMA CORP (JP) 2012-03-28 EP disclosed
EP-1308438-B1 3-SUBSTITUTED UREA DERIVATIVES AND MEDICINAL USE THEREOF MITSUBISHI TANABE PHARMA CORP (JP) 2010-10-20 EP disclosed
US-7105567-B2 3-substituted urea derivatives and medicinal use thereof MITSUBISHI PHARMA CORPORATION (JP) 2006-09-12 US disclosed
US-20030207939-A1 Novel 3-substituted urea derivatives and medicinal use thereof MITSUBISHI PHARMA CORPORATION (JP) 2003-11-06 US disclosed
EP-1308438-A1 3-SUBSTITUTED UREA DERIVATIVES AND MEDICINAL USE THEREOF Mitsubishi Pharma Corporation (JP) 2003-05-07 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-20030207939-A1 Novel 3-substituted urea derivatives and medicinal use thereof C5AR1, C5AR2, C3AR1 SOAT2 3181/4885ACAT1 1730/4885SOAT1 1923/4885

“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.