SCHEMBL4136924

SCHEMBL4136924

CCCCCCCCCCCCCCNC(=O)Nc1cc(C)nn1C

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.58
KMT2A Q03164 2/20 0.58
SMN1; SMN2 Q16637 1/20 0.57
EPHX1 P07099 13/20 0.50
HTT P42858 2/20 0.50
ALDH1A1 P00352 1/20 0.50
ASAH1 Q13510 1/20 0.50
EPHX2 P34913 1/20 0.49
KDM4E B2RXH2 1/20 0.46

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
SCHEMBL4145849 1.00 MEN1 (0.58) MEN1KMT2ASMN1; SMN2EPHX1HTT
SCHEMBL4132285 1.00 MEN1 (0.58) MEN1KMT2ASMN1; SMN2EPHX1HTT
SCHEMBL4135897 1.00 MEN1 (0.58) MEN1KMT2ASMN1; SMN2EPHX1HTT
SCHEMBL4127216 1.00 MEN1 (0.58) MEN1KMT2ASMN1; SMN2EPHX1HTT
SCHEMBL4137645 1.00 MEN1 (0.58) MEN1KMT2ASMN1; SMN2EPHX1HTT
SCHEMBL4132087 1.00 MEN1 (0.58) MEN1KMT2ASMN1; SMN2EPHX1HTT
SCHEMBL4142888 0.94 MEN1 (0.61) MEN1KMT2ASMN1; SMN2EPHX1HTT
SCHEMBL4141705 0.84 ATM (0.55) MEN1KMT2AEPHX1HTTALDH1A1
SCHEMBL4138182 0.83 MAPK14 (0.55)
SCHEMBL13772474 0.83 MAPK14 (0.55)

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-20090192192-A1 INHIBITORS OF BIOFILM FORMATION OF GRAM-POSITIVE AND GRAM-NEGATIVE BACTERIA TOUCH BIONICS LIMITED (GB) 2009-07-30 US disclosed
US-20090192192-A1 INHIBITORS OF BIOFILM FORMATION OF GRAM-POSITIVE AND GRAM-NEGATIVE BACTERIA TOUCH BIONICS LIMITED (GB) 2009-07-30 US disclosed
US-20090192192-A1 INHIBITORS OF BIOFILM FORMATION OF GRAM-POSITIVE AND GRAM-NEGATIVE BACTERIA TOUCH BIONICS LIMITED (GB) 2009-07-30 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-20090192192-A1 INHIBITORS OF BIOFILM FORMATION OF GRAM-POSITIVE AND GRAM-NEGATIVE BACTERIA PGLS, TFPI, Q6ZSR9 MEN1 4659/4885KMT2A 3636/4885SMN1; SMN2 4885/4885

“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.