SCHEMBL10061567

SCHEMBL10061567

CCCCOCCCCc1cccnc1

nearest known ligand 0.75

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.75
TDP1 Q9NUW8 1/20 0.75
HRH1 P35367 2/20 0.54
CYP2A6 P11509 1/20 0.53
TBXAS1 P24557 7/20 0.50
CYP3A4 P08684 1/20 0.49
CYP2D6 P10635 1/20 0.49
CYP19A1 P11511 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
TRPV1 Q8NER1 1/20 0.48
CHRNA7 P36544 2/20 0.47

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
SCHEMBL23015074 0.92 TDP1 (0.68) L3MBTL1TDP1HRH1CYP2A6TBXAS1
SCHEMBL23014817 0.87 TDP1 (0.65) L3MBTL1TDP1HRH1CYP2A6TBXAS1
SCHEMBL135032 0.86 TDP1 (1.00) L3MBTL1TDP1HRH1CYP2A6TBXAS1
Bromide SCHEMBL15822430 0.84 TDP1 (0.96) L3MBTL1TDP1HRH1CYP2A6TBXAS1
SCHEMBL6115248 0.84 TDP1 (0.96) L3MBTL1TDP1HRH1CYP2A6TBXAS1
SCHEMBL6114843 0.84 TDP1 (0.96) L3MBTL1TDP1HRH1CYP2A6TBXAS1
SCHEMBL25380936 0.84 TDP1 (0.96) L3MBTL1TDP1HRH1CYP2A6TBXAS1
SCHEMBL25381701 0.84 TDP1 (0.96) L3MBTL1TDP1HRH1CYP2A6TBXAS1
SCHEMBL6114977 0.84 TDP1 (0.96) L3MBTL1TDP1HRH1CYP2A6TBXAS1
SCHEMBL25381172 0.84 TDP1 (0.96) L3MBTL1TDP1HRH1CYP2A6TBXAS1

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-20120022040-A1 ANTIMICROBIALS AMPLYX PHARMACEUTICALS, INC. 2012-01-26 US disclosed
WO-2010065110-A2 ANTIMICROBIALS AMPLYX PHARMACEUTICALS, INC. (US) 2010-06-10 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-20120022040-A1 ANTIMICROBIALS PAM, MPO, OXA1L L3MBTL1 2171/4885TDP1 4592/4885HRH1 1866/4885

“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.