SCHEMBL18477154

SCHEMBL18477154

CC(=O)N1CCN(C(=S)N/N=C2/CCNc3cccnc32)CC1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTAFR P25105 11/20 0.40
HSP90AA1 P07900 4/20 0.40
SMO Q99835 2/20 0.36
FNTA P49354 2/20 0.35
FNTB P49356 2/20 0.35
HRH1 P35367 1/20 0.35
SLC6A15 Q9H2J7 1/20 0.35
HKDC1 Q2TB90 1/20 0.35
MITF O75030 1/20 0.35

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
SCHEMBL18477152 0.89 HSP90AA1 (0.39) HSP90AA1HRH1HKDC1MITF
SCHEMBL18477166 0.87 HSP90AA1 (0.38) HSP90AA1HKDC1
SCHEMBL18477147 0.87 MEN1 (0.38) HSP90AA1SMOFNTAFNTBHKDC1
SCHEMBL18477157 0.86 HSP90AA1 (0.37) HSP90AA1HRH1HKDC1MITF
SCHEMBL18477165 0.86 LMNA (0.37) HSP90AA1
SCHEMBL18479516 0.86 KDM4E (0.47)
SCHEMBL18477144 0.85 HSP90AA1 (0.38) HSP90AA1HKDC1MITF
SCHEMBL18477155 0.85 ALDH1A1 (0.41) HSP90AA1
SCHEMBL18477158 0.84 HSP90AA1 (0.45) HSP90AA1HRH1HKDC1
SCHEMBL18477866 0.84 MEN1 (0.40) HSP90AA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10392397-B2 Heterocyclic thiosemicarbazone derivatives and their therapeutical applications NANTBIO, INC. (US) 2019-08-27 US disclosed
US-20180208603-A1 HETEROCYCLIC THIOSEMICARBAZONE DERIVATIVES AND THEIR THERAPEUTICAL APPLICATIONS NANT HOLDINGS IP, LLC 2018-07-26 US disclosed
US-20180208603-A1 HETEROCYCLIC THIOSEMICARBAZONE DERIVATIVES AND THEIR THERAPEUTICAL APPLICATIONS NANT HOLDINGS IP, LLC 2018-07-26 US disclosed
WO-2017024315-A1 HETEROCYCLIC THIOSEMICARBAZONE DERIVATIVES AND THEIR THERAPEUTICAL APPLICATIONS NANT HOLDINGS IP, LLC (US) 2017-02-09 WO 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-10392397-B2 Heterocyclic thiosemicarbazone derivatives and their therapeutical applications TPMT, MKI67, TST PTAFR 1946/4885HSP90AA1 158/4885SMO 480/4885
US-20180208603-A1 HETEROCYCLIC THIOSEMICARBAZONE DERIVATIVES AND THEIR THERAPEUTICAL APPLICATIONS TPMT, MKI67, TST PTAFR 1946/4885HSP90AA1 158/4885SMO 480/4885

“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.