SCHEMBL23734209

SCHEMBL23734209

CC(C)(C)OC(=O)N1CCC(NC(=O)c2ccc3cnn(-c4ccccc4)c3c2)CC1

nearest known ligand 0.66

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KHK P50053 4/20 0.66
▸ POLB P06746 1/20 0.63
▸ LMNA P02545 3/20 0.60
▸ THRB P10828 1/20 0.60
▸ MEN1 O00255 1/20 0.53
▸ KMT2A Q03164 1/20 0.53
▸ MAPT P10636 2/20 0.53
▸ TP53 P04637 2/20 0.52
▸ DGAT2 Q96PD7 2/20 0.51
▸ HPGDS O60760 1/20 0.51
▸ HDAC4 P56524 1/20 0.50

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
SCHEMBL3720050 0.89 POLB (0.60) KHKPOLBLMNATHRBMEN1
SCHEMBL4940990 0.84 USP30 (0.56) POLBLMNATHRBDGAT2HDAC4
SCHEMBL3724794 0.84 USP30 (0.56) POLBLMNATHRBDGAT2HDAC4
SCHEMBL22358112 0.82 HDAC4 (0.54) POLBLMNATHRBMEN1KMT2A
SCHEMBL31279611 0.80 KHK (1.00) KHKHPGDS
SCHEMBL23711737 0.80 KHK (1.00) KHKHPGDS
SCHEMBL13199301 0.79 KDM4E (0.68) POLBLMNATHRBMEN1KMT2A
SCHEMBL3668808 0.78 LMNA (0.49) POLBLMNATHRBMEN1KMT2A
SCHEMBL7756336 0.78 HDAC4 (0.51) POLBLMNATHRBMEN1KMT2A
SCHEMBL3720046 0.77 ALDH1A1 (0.58) POLBLMNATHRBMEN1KMT2A

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-11083720-B2 Indazole inhibitors of fructokinase (KHK) and methods of use in treating KHK-mediated disorders or diseases REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE (US) 2021-08-10 — — 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-11083720-B2 Indazole inhibitors of fructokinase (KHK) and methods of use in treating KHK-mediated disorders or diseases KHK, GCK, HK1 KHK 1/4885POLB 4241/4885LMNA 4468/4885

“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.

Send feedback