SCHEMBL10246872

SCHEMBL10246872

COc1ccc(C(C(=O)NC2CCCc3cc(C(=O)NO)ccc32)c2ccccc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.54
KMT2A Q03164 4/20 0.54
DHODH Q02127 1/20 0.49
HTT P42858 1/20 0.48
TAS1R3 Q7RTX0 1/20 0.48
TAS1R1 Q7RTX1 1/20 0.48
TAS1R2 Q8TE23 1/20 0.48
ALDH1A1 P00352 2/20 0.48
ATM Q13315 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
MAPT P10636 1/20 0.46
LMNA P02545 1/20 0.45
POLB P06746 1/20 0.44

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
SCHEMBL10254316 0.89 TAOK3 (0.48) KMT2AHTTTAS1R3TAS1R1TAS1R2
SCHEMBL10249682 0.82 HDAC1 (0.50) MEN1KMT2AHTTTAS1R3TAS1R1
SCHEMBL10249684 0.75 HTT (0.62) MEN1KMT2AHTTTAS1R3TAS1R1
SCHEMBL10246858 0.74 TAS1R3 (0.45) MEN1KMT2AHTTTAS1R3TAS1R1
SCHEMBL10246958 0.73 MEN1 (0.53) MEN1KMT2ADHODHTAS1R3TAS1R1
SCHEMBL10247155 0.73 LMNA (0.77) MEN1KMT2AHTTTAS1R3TAS1R1
SCHEMBL10247153 0.72 LMNA (0.50) MEN1KMT2AHTTTAS1R3TAS1R1
SCHEMBL10246997 0.72 LMNA (0.62) MEN1KMT2ADHODHHTTTAS1R3
SCHEMBL10246877 0.71 HDAC1 (0.54) MEN1KMT2AHTTTAS1R3TAS1R1
SCHEMBL10246945 0.71 SMN1; SMN2 (0.47) MEN1KMT2AHTTTAS1R3TAS1R1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140243335-A1 SUBSTITUTED HYDOXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2014-08-28 US disclosed
US-20140243335-A1 SUBSTITUTED HYDOXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2014-08-28 US disclosed
US-20140243335-A1 SUBSTITUTED HYDOXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2014-08-28 US disclosed
US-20120015943-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACUTICALS, INC. (US) 2012-01-19 US disclosed
US-20120015943-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACUTICALS, INC. (US) 2012-01-19 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 (2 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-20120015943-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF HDAC6, HDAC1, HDAC2 MEN1 3532/4885KMT2A 37/4885DHODH 1593/4885
US-20140243335-A1 SUBSTITUTED HYDOXAMIC ACIDS AND USES THEREOF HDAC6, HDAC1, H1-3 MEN1 3795/4885KMT2A 62/4885DHODH 429/4885

“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.