SCHEMBL10246902

SCHEMBL10246902

COc1ccccc1-c1cc(C(=O)N[C@H]2CCCc3cc(C(=O)NO)ccc32)[nH]n1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.48
MEN1 O00255 4/20 0.48
POLB P06746 1/20 0.48
TAS1R3 Q7RTX0 3/20 0.48
TAS1R1 Q7RTX1 3/20 0.48
TDP1 Q9NUW8 1/20 0.48
PDE4A P27815 1/20 0.46
PDE4B Q07343 1/20 0.46
PDE4C Q08493 1/20 0.46
PDE4D Q08499 1/20 0.46
ROCK2 O75116 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.44
LMNA P02545 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
SCHEMBL10247071 0.81 HDAC8 (0.52) KMT2AMEN1TAS1R3TAS1R1LMNA
SCHEMBL10249731 0.81 HDAC8 (0.52) KMT2AMEN1TAS1R3TAS1R1LMNA
SCHEMBL10247022 0.81 LMNA (0.48) KMT2AMEN1POLBTAS1R3TAS1R1
SCHEMBL10247230 0.81 LMNA (0.48) KMT2AMEN1POLBTAS1R3TAS1R1
SCHEMBL15969684 0.76 HDAC6 (0.43) KMT2AMEN1POLB
SCHEMBL10252064 0.74 TAS1R3 (0.49) KMT2AMEN1POLBTAS1R3TAS1R1
SCHEMBL10249678 0.74 CHRNA7 (0.52) KMT2AMEN1POLBTAS1R3TAS1R1
SCHEMBL10249684 0.72 HTT (0.62) KMT2AMEN1TAS1R3TAS1R1L3MBTL1
SCHEMBL10247155 0.72 LMNA (0.77) KMT2AMEN1TAS1R3TAS1R1LMNA
SCHEMBL10246997 0.72 LMNA (0.62) KMT2AMEN1TAS1R3TAS1R1L3MBTL1

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
WO-2012012322-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2012-01-26 WO 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 KMT2A 37/4885MEN1 3532/4885POLB 306/4885
US-20140243335-A1 SUBSTITUTED HYDOXAMIC ACIDS AND USES THEREOF HDAC6, HDAC1, H1-3 KMT2A 62/4885MEN1 3795/4885POLB 660/4885

“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.