SCHEMBL7040487

SCHEMBL7040487

Cn1cc(NC(=O)c2ccccc2-c2ccc(C(F)(F)F)cc2)nc1C(=O)NCc1ccc(-c2ccc(Cl)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MTTP P55157 14/20 0.47
KLRK1 P26718 1/20 0.46
MICA Q29983 1/20 0.46
RAET1L Q5VY80 1/20 0.46
PPARG P37231 1/20 0.45
GAA P10253 1/20 0.45
CNR1 P21554 1/20 0.44
CNR2 P34972 1/20 0.44
APOB P04114 1/20 0.42

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
SCHEMBL7109972 0.96 MTTP (0.50) MTTPPPARGGAAAPOB
SCHEMBL7039285 0.95 MTTP (0.51) MTTPPPARGGAAAPOB
SCHEMBL7043104 0.93 MTTP (0.47) MTTPPPARGGAA
SCHEMBL7042822 0.93 MTTP (0.47) MTTPPPARGGAAAPOB
SCHEMBL7043050 0.93 MTTP (0.47) MTTPPPARGGAAAPOB
SCHEMBL7043378 0.88 MTTP (0.45) MTTPPPARGGAAAPOB
SCHEMBL7038654 0.87 MTTP (0.51) MTTPPPARGGAAAPOB
SCHEMBL7038151 0.87 PTPN1 (0.45) MTTPPPARGGAA
SCHEMBL7036344 0.85 FAAH (0.45) MTTP
SCHEMBL7039180 0.84 MTTP (0.49) MTTPKLRK1MICARAET1LPPARG

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-20030162788-A1 Combination of MTP inhibitors or apoB-secretion inhibitors with fibrates for use as pharmaceuticals BOEHRINGER INGELHEIM PHARMA KG (DE) 2003-08-28 US disclosed
US-20030073836-A1 Heteroarylcarboxylic acid amides, the preparation thereof and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA KG (DE) 2003-04-17 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 (2 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-20030162788-A1 Combination of MTP inhibitors or apoB-secretion inhibitors with fibrates for use as pharmaceuticals APOB, LIPC, MTPN MTTP 9/4885KLRK1 1927/4885MICA 1403/4885
US-20030073836-A1 Heteroarylcarboxylic acid amides, the preparation thereof and their use as pharmaceutical compositions MTTP, CETP, CES1 MTTP 1/4885KLRK1 4354/4885MICA 2981/4885

“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.