SCHEMBL492800

SCHEMBL492800

CN(C)C(c1ccc(F)cc1)C1CCC(CNC(=O)COCCN(C)S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 1/20 0.38
LMNA P02545 1/20 0.38
GAA P10253 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TRPA1 O75762 6/20 0.37
CACNA1B Q00975 5/20 0.37
RORC P51449 1/20 0.37
GRM5 P41594 1/20 0.36
BDKRB1 P46663 3/20 0.36
CACNA1C Q13936 1/20 0.36
NR1I2 O75469 1/20 0.35
CYP3A4 P08684 1/20 0.35
NPSR1 Q6W5P4 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
SCHEMBL492988 0.94 LMNA (0.44) PTGIRLMNAGAASMN1; SMN2CACNA1B
SCHEMBL493314 0.93 LMNA (0.39) PTGIRLMNAGAASMN1; SMN2CACNA1B
SCHEMBL493499 0.93 CCR2 (0.40) PTGIRLMNAGAASMN1; SMN2CACNA1B
SCHEMBL493159 0.93 BDKRB1 (0.38) LMNAGAASMN1; SMN2CACNA1BBDKRB1
SCHEMBL493164 0.90 LMNA (0.46) LMNAGAASMN1; SMN2CACNA1BBDKRB1
SCHEMBL493538 0.88 HTT (0.40) PTGIRLMNASMN1; SMN2TRPA1
SCHEMBL493170 0.87 LMNA (0.39) LMNAGAASMN1; SMN2CACNA1BRORC
SCHEMBL493982 0.87 LMNA (0.37) PTGIRLMNAGAASMN1; SMN2CACNA1B
SCHEMBL492699 0.87 PTGIR (0.38) PTGIRLMNAGAASMN1; SMN2CACNA1B
SCHEMBL492544 0.86 PTGIR (0.41) PTGIRLMNASMN1; SMN2TRPA1

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-8106055-B2 Substituted amide compounds GRUENENTHAL GMBH (DE) 2012-01-31 US claimed
US-20080306084-A1 Substituted Amide Compounds GRUENENTHAL GMBH (DE) 2008-12-11 US claimed
US-8106055-B2 Substituted amide compounds GRUENENTHAL GMBH (DE) 2012-01-31 US disclosed
US-20080306084-A1 Substituted Amide Compounds GRUENENTHAL GMBH (DE) 2008-12-11 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-20080306084-A1 Substituted Amide Compounds OPRK1, NAA50, ACMSD PTGIR 121/4885LMNA 2485/4885GAA 445/4885

“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.