SCHEMBL31689736

SCHEMBL31689736

COc1nc(Br)nc(Br)n1

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
ATM Q13315 2/20 0.34
MAPT P10636 1/20 0.34
TSHR P16473 1/20 0.34
HTT P42858 1/20 0.34
RECQL P46063 1/20 0.34
PRNP P04156 1/20 0.32
CYP1A2 P05177 2/20 0.32
CYP2C19 P33261 1/20 0.31
LMNA P02545 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
ALDH1A1 P00352 2/20 0.30

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
SCHEMBL11779440 0.94 ALDH1A1 (0.35) MEN1KMT2AATMMAPTTSHR
SCHEMBL33145 0.75 ALDH1A1 (0.43) MEN1KMT2AATMMAPTTSHR
SCHEMBL2725593 0.71 TSHR (0.42) MEN1KMT2AATMMAPTTSHR
SCHEMBL18120548 0.69 CYP1A2 (0.47) MEN1KMT2AATMMAPTTSHR
SCHEMBL10637349 0.67 ALDH1A1 (0.50) MEN1KMT2AATMMAPTTSHR
SCHEMBL8595031 0.66 LMNA (0.52) MEN1KMT2AATMMAPTTSHR
SCHEMBL8656719 0.65 LMNA (0.48) MAPTHTTRECQLCYP1A2LMNA
SCHEMBL3517644 0.65 MEN1 (0.32) MEN1KMT2AATMMAPTTSHR
SCHEMBL8844371 0.65 GAA (0.47) MEN1KMT2AATMMAPTTSHR
SCHEMBL1131131 0.65 GAA (0.47) MEN1KMT2AATMMAPTTSHR

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12427506-B1 Method for carbon dioxide fixation using a palladium-doped nitrogen-rich organic framework catalyst KING FAHD UNIVERSITY OF PETROLEUM AND MINERALS (SA) 2025-09-30 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-12427506-B1 Method for carbon dioxide fixation using a palladium-doped nitrogen-rich organic framework catalyst POF1B, CYP4F12, ETFB MEN1 3131/4885KMT2A 2319/4885ATM 4787/4885

“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.