SCHEMBL16327151

SCHEMBL16327151

Cc1ccc(CN(C)CC2CC2)cc1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PYCR1 P32322 1/20 0.50
TAS2R14 Q9NYV8 4/20 0.46
CXCR3 P49682 2/20 0.41
NPSR1 Q6W5P4 1/20 0.41
CNR1 P21554 1/20 0.40
CNR2 P34972 1/20 0.40
SLC6A2 P23975 1/20 0.40
SLC6A4 P31645 1/20 0.40
LSS P48449 2/20 0.39
KCNA5 P22460 1/20 0.37

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
SCHEMBL4267535 0.83 CXCR3 (0.41) TAS2R14CXCR3LSS
SCHEMBL1240985 0.83 PYCR1 (0.51) PYCR1CXCR3LSS
SCHEMBL17887960 0.83 PYCR1 (0.51) PYCR1TAS2R14CXCR3SLC6A2SLC6A4
SCHEMBL14045705 0.82 ALDH1A1 (0.52) PYCR1
SCHEMBL22794600 0.81 SLC6A2 (0.39) PYCR1SLC6A2SLC6A4LSS
SCHEMBL12891100 0.80 EP300 (0.47) PYCR1CXCR3SLC6A2SLC6A4LSS
SCHEMBL26668497 0.79 EP300 (0.46) CXCR3SLC6A2SLC6A4LSS
SCHEMBL16312619 0.79 PYCR1 (0.65) PYCR1NPSR1
SCHEMBL8283980 0.77 ALDH1A1 (0.46) PYCR1
SCHEMBL4686478 0.75 CARM1 (0.47) PYCR1

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-7879808-B2 potent activity against resistant pneumococci; for treating domestic fowl MEIJI SEIKA KAISHA, LTD. (JP) 2011-02-01 US disclosed
US-20100210570-A1 LINCOMYCIN DERIVATIVES AND ANTIMICROBIAL AGENTS COMPRISING THE SAME AS ACTIVE INGREDIENT MEIJI SEIKA KAISHA LTD. (JP) 2010-08-19 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-20100210570-A1 LINCOMYCIN DERIVATIVES AND ANTIMICROBIAL AGENTS COMPRISING THE SAME AS ACTIVE INGREDIENT LAS1L, LCLAT1, LYPLA1 PYCR1 258/4885TAS2R14 2862/4885CXCR3 3783/4885

“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.