SCHEMBL10272299

SCHEMBL10272299

CN1CCc2nc(O)c(C#N)cc2C1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 12/20 0.52
KDM4E B2RXH2 11/20 0.52
ALDH1A1 P00352 10/20 0.52
KMT2A Q03164 4/20 0.52
MEN1 O00255 3/20 0.52
RAB9A P51151 1/20 0.52
HPGD P15428 5/20 0.50
USP2 O75604 3/20 0.50
LMNA P02545 3/20 0.50
HTT P42858 2/20 0.50
GAA P10253 2/20 0.50
PKM P14618 1/20 0.50
CASP1 P29466 1/20 0.50
CYP2C19 P33261 1/20 0.50
ALOX15 P16050 2/20 0.49
TSHR P16473 1/20 0.49
HSD17B10 Q99714 1/20 0.49
HIF1A Q16665 1/20 0.47
NPSR1 Q6W5P4 2/20 0.46
CYP2C9 P11712 1/20 0.45

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
SCHEMBL19674713 0.83 KDM4E (0.54) MAPTKDM4EALDH1A1KMT2AMEN1
SCHEMBL14954856 0.82 MAPT (0.50) MAPTKDM4EALDH1A1KMT2AMEN1
SCHEMBL1036093 0.82 SMN1; SMN2 (0.60) MAPTKDM4EALDH1A1KMT2AMEN1
SCHEMBL10272301 0.78 MAPT (0.49) MAPTKDM4EALDH1A1KMT2AMEN1
SCHEMBL25946966 0.76 CYP2C19 (0.50) MAPTKDM4EALDH1A1KMT2AMEN1
SCHEMBL29741196 0.76 SMN1; SMN2 (0.65) KDM4EALDH1A1KMT2ARAB9AHPGD
SCHEMBL4107462 0.76 SMN1; SMN2 (0.65) KDM4EALDH1A1KMT2ARAB9AHPGD
SCHEMBL16019317 0.76 SMN1; SMN2 (0.60) MAPTKDM4EALDH1A1KMT2AMEN1
SCHEMBL19674753 0.72 CYP2C9 (0.48) MAPTKDM4EALDH1A1KMT2AMEN1
SCHEMBL3306895 0.72 MAPT (0.44) MAPTKDM4EALDH1A1KMT2AMEN1

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-20120053201-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2012-03-01 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-20120053201-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF HDAC6, HDAC1, HDAC2 MAPT 2421/4885KDM4E 902/4885ALDH1A1 529/4885

“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.