SCHEMBL346726

SCHEMBL346726

CC(C)N1CCC(C)(C(=O)Nc2cc(-c3ccc4c(c3)CCC(C(=O)NO)C4)ccn2)CC1

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 16/20 0.41
DYRK1A Q13627 4/20 0.40
WNT1 P04628 1/20 0.40
PIK3C3 Q8NEB9 2/20 0.38
FAAH O00519 2/20 0.37
MAPK14 Q16539 1/20 0.36

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
SCHEMBL345400 0.91 GSK3B (0.43) GSK3BDYRK1AWNT1PIK3C3FAAH
SCHEMBL434456 0.89 BRAF (0.46) FAAH
SCHEMBL10197879 0.88 GSK3B (0.41) GSK3BPIK3C3FAAHMAPK14
SCHEMBL346196 0.87 GSK3B (0.46) GSK3BPIK3C3FAAHMAPK14
SCHEMBL346787 0.86 GRIA2 (0.40) FAAH
SCHEMBL346770 0.81 NPC1 (0.38)
SCHEMBL353250 0.78 HDAC8 (0.40)
SCHEMBL436430 0.76 GHSR (0.42) FAAH
SCHEMBL353143 0.76 HDAC8 (0.39) GSK3BDYRK1AWNT1
SCHEMBL353174 0.74 SYK (0.42) GSK3BDYRK1AWNT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140243334-A1 SUBSTITUTED HYDOXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2014-08-28 US disclosed
US-20140243334-A1 SUBSTITUTED HYDOXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2014-08-28 US disclosed
WO-2012012320-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENIUM PHARMACEUTICALS, INC. (US) 2012-01-26 WO disclosed
US-20120015942-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2012-01-19 US disclosed
US-20120015942-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2012-01-19 US disclosed
US-20120015942-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, 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-20120015942-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF HDAC6, HDAC1, HDAC2 GSK3B 81/4885DYRK1A 2025/4885WNT1 3898/4885
US-20140243334-A1 SUBSTITUTED HYDOXAMIC ACIDS AND USES THEREOF HDAC6, H1-3, H1-5 GSK3B 491/4885DYRK1A 2205/4885WNT1 3369/4885

“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.