SCHEMBL5776386

SCHEMBL5776386

COc1cc(Br)cc(/C=N/Nc2ccc(-n3ccnc3)cc2)c1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA9 Q16790 1/20 0.44
ERN1 O75460 8/20 0.44
MAPT P10636 6/20 0.43
MEN1 O00255 5/20 0.43
KMT2A Q03164 5/20 0.43
GAA P10253 4/20 0.43
KDM4E B2RXH2 3/20 0.43
ALDH1A1 P00352 2/20 0.43
POLB P06746 3/20 0.43
LMNA P02545 2/20 0.41
HTT P42858 2/20 0.41
NPC1 O15118 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
ALOX12 P18054 1/20 0.41
CYP2C19 P33261 1/20 0.41

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
SCHEMBL5776390 1.00 CA12 (0.44) CA12CA1CA2CA9ERN1
SCHEMBL5778973 0.84 CA12 (0.54) CA12CA1CA2CA9MAPT
SCHEMBL5778976 0.84 CA12 (0.54) CA12CA1CA2CA9MAPT
SCHEMBL5779515 0.84 MAPT (0.65) CA12CA1CA2CA9MAPT
SCHEMBL5779517 0.84 MAPT (0.65) CA12CA1CA2CA9MAPT
SCHEMBL5778732 0.80 CA12 (0.49) CA12CA1CA2CA9MAPT
SCHEMBL5778730 0.80 CA12 (0.49) CA12CA1CA2CA9MAPT
SCHEMBL5775551 0.78 CA12 (0.52) CA12CA1CA2CA9MAPT
SCHEMBL5780077 0.78 MPO (0.63) CA12CA1CA2CA9MAPT
SCHEMBL5780079 0.78 MPO (0.63) CA12CA1CA2CA9MAPT

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-20060276433-A1 Hydrazone derivative DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2006-12-07 US disclosed
EP-1612204-A1 HYDRAZONE DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2006-01-04 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-20060276433-A1 Hydrazone derivative APP, PRNP, HTT CA12 3569/4885CA1 763/4885CA2 1416/4885

“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.