SCHEMBL3404873

SCHEMBL3404873

CCN1C(=O)c2cccc3c(NN)ccc(c23)C1=O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.67
CYP1B1 Q16678 3/20 0.67
MEN1 O00255 3/20 0.67
USP2 O75604 3/20 0.67
ATM Q13315 2/20 0.67
KEAP1 Q14145 2/20 0.67
NFE2L2 Q16236 2/20 0.67
ALDH1A1 P00352 5/20 0.62
KDM4E B2RXH2 2/20 0.62
LMNA P02545 2/20 0.62
BRD4 O60885 9/20 0.56
MAPT P10636 4/20 0.55
NPSR1 Q6W5P4 3/20 0.55
HTT P42858 3/20 0.55
RGS12 O14924 1/20 0.55
POLB P06746 1/20 0.55
MAPK1 P28482 1/20 0.55
TLR9 Q9NR96 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55

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
SCHEMBL27864563 0.86 KMT2A (0.75) KMT2ACYP1B1MEN1USP2ATM
SCHEMBL17833832 0.85 KMT2A (0.62) KMT2ACYP1B1MEN1USP2ATM
SCHEMBL27858387 0.84 KMT2A (0.68) KMT2ACYP1B1MEN1USP2ATM
SCHEMBL27874865 0.84 KMT2A (0.68) KMT2ACYP1B1MEN1USP2ATM
SCHEMBL31373066 0.83 MEN1 (0.64) KMT2ACYP1B1MEN1USP2ATM
SCHEMBL28332982 0.83 HEXA (0.57) KMT2ACYP1B1MEN1USP2ATM
SCHEMBL30926161 0.82 HEXA (0.60) KMT2AMEN1USP2ATMKEAP1
SCHEMBL28132850 0.82 KMT2A (0.49) KMT2ACYP1B1MEN1USP2ATM
SCHEMBL9437196 0.82 ALDH1A1 (0.67) KMT2ACYP1B1MEN1USP2ATM
SCHEMBL8293068 0.81 KMT2A (0.54) KMT2ACYP1B1MEN1USP2ATM

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-20200407318-A1 COMPOUND AND DIMER COMPLEX EMBODIMENTS FOR SUPRAMOLECULAR SENSING UVIC INDUSTRY PARTNERSHIPS INC. (CA) 2020-12-31 US disclosed
EP-2251687-A1 Colorimetric anion sensor element The Provost Fellows And Scholars Of The College Of The Holy and Undivided Trinity Of Queen Elizabeth Near Dublin (IE) 2010-11-17 EP disclosed
EP-2251687-A1 Colorimetric anion sensor element The Provost Fellows And Scholars Of The College Of The Holy and Undivided Trinity Of Queen Elizabeth Near Dublin (IE) 2010-11-17 EP 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-20200407318-A1 COMPOUND AND DIMER COMPLEX EMBODIMENTS FOR SUPRAMOLECULAR SENSING OPRM1, CNR2, CNR1 KMT2A 3272/4885CYP1B1 1740/4885MEN1 3895/4885

“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.