SCHEMBL10620559

SCHEMBL10620559

Cc1ccc(C(CN(C)C)CN(C)C)cc1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 1/20 0.50
HTR2A P28223 1/20 0.43
HRH1 P35367 1/20 0.43
TDP1 Q9NUW8 2/20 0.41
TSHR P16473 2/20 0.39
ALDH1A1 P00352 1/20 0.39
ACHE P22303 2/20 0.38
SLC6A2 P23975 4/20 0.35
SLC6A4 P31645 4/20 0.35
SLC6A3 Q01959 4/20 0.35
ALOX5 P09917 1/20 0.34
LMNA P02545 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ATM Q13315 1/20 0.34

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
SCHEMBL16327095 0.87 CHRNA7 (0.43) CHRNA7HTR2AHRH1TDP1TSHR
SCHEMBL3028964 0.79 TAAR1 (0.43) HTR2AHRH1TDP1TSHRSLC6A2
SCHEMBL8754723 0.78 HTR2A (0.70) HTR2AHRH1TDP1TSHRALDH1A1
SCHEMBL10429837 0.77 HTR2A (0.47) CHRNA7HTR2AHRH1
SCHEMBL16327150 0.77 AOC3 (0.48) CHRNA7HTR2AHRH1ALDH1A1SLC6A2
SCHEMBL26921899 0.77 CHRNA7 (0.46) CHRNA7HTR2AHRH1TDP1TSHR
SCHEMBL12891079 0.76 KCNH2 (0.43) HTR2AHRH1TDP1TSHRALDH1A1
SCHEMBL3989199 0.72 ADRA2A (0.48) CHRNA7TDP1ALDH1A1ACHESLC6A2
SCHEMBL4415127 0.71 ACHE (0.43) CHRNA7ALDH1A1ACHESLC6A2SLC6A4
SCHEMBL16151931 0.71 ACHE (0.43) CHRNA7ALDH1A1ACHESLC6A2SLC6A4

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-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
US-4791063-A REMOVAL OF CONTAMINANTS FROM BIOLOGICAL FLUIDS CUNO INCORPORATED (US) 1988-12-13 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 CHRNA7 4720/4885HTR2A 3515/4885HRH1 1405/4885

“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.