SCHEMBL6718630

SCHEMBL6718630

[CH2]C=CCC(c1ccccc1)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 6/20 0.42
TAAR1 Q96RJ0 1/20 0.42
CYP2C19 P33261 1/20 0.39
HRH1 P35367 5/20 0.39
LMNA P02545 1/20 0.38
TDP1 Q9NUW8 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
CHRNB2 P17787 1/20 0.35
CHRNA4 P43681 1/20 0.35
DPP4 P27487 2/20 0.35
F2 P00734 1/20 0.35
TSHR P16473 1/20 0.35

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
SCHEMBL6718628 1.00 HTR2A (0.42) HTR2ATAAR1CYP2C19HRH1LMNA
SCHEMBL2095864 0.77 HRH1 (0.46) HTR2ATAAR1CYP2C19HRH1LMNA
SCHEMBL2095865 0.77 HRH1 (0.46) HTR2ATAAR1CYP2C19HRH1LMNA
SCHEMBL691762 0.75 CYP2C19 (0.57) HTR2ATAAR1CYP2C19HRH1TDP1
SCHEMBL8599444 0.74 LMNA (0.46) HTR2ATAAR1HRH1LMNATDP1
SCHEMBL8599440 0.74 LMNA (0.46) HTR2ATAAR1HRH1LMNATDP1
SCHEMBL7245503 0.74 HTR2A (0.41) HTR2ATAAR1CYP2C19HRH1LMNA
SCHEMBL7244288 0.74 HTR2A (0.41) HTR2ATAAR1CYP2C19HRH1LMNA
SCHEMBL28692144 0.74 HTR2A (0.59) HTR2ATAAR1CYP2C19HRH1LMNA
SCHEMBL5405861 0.74 LMNA (0.41) HTR2ATAAR1CYP2C19HRH1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040034028-A1 4-(biphenylcarbonylamino)piperidine derivatives as mtp inhibitors MERCK PATENT GMBH (DE) 2004-02-19 US disclosed
EP-1335912-A1 4-(BIPHENYLCARBONYLAMINO)PIPERIDINE DERIVATIVES AS MTP INHIBITORS MERCK PATENT GmbH (DE) 2003-08-20 EP disclosed
WO-2002042291-A1 4-(BIPHENYLCARBONYLAMINO)PIPERIDINE DERIVATIVES AS MTP INHIBITORS MERCK PATENT GMBH (DE) 2002-05-30 WO 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-20040034028-A1 4-(biphenylcarbonylamino)piperidine derivatives as mtp inhibitors LIPC, CETP, MTTP HTR2A 2250/4885TAAR1 569/4885CYP2C19 495/4885

“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.