SCHEMBL20117138

SCHEMBL20117138

CC(C)(C)OC(=O)N1CCN(c2nc(-c3cccc(C4CCOC4)c3)no2)CC1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.44
TP53 P04637 3/20 0.44
GPR119 Q8TDV5 3/20 0.43
GRM5 P41594 2/20 0.43
LMNA P02545 3/20 0.43
NPC1 O15118 1/20 0.43
HTT P42858 1/20 0.43
HDAC4 P56524 2/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
THRB P10828 2/20 0.41
PIK3CA P42336 2/20 0.41
CKS1B P61024 1/20 0.40
SKP1 P63208 1/20 0.40
SKP2 Q13309 1/20 0.40

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
SCHEMBL20116165 0.90 MAPT (0.47) MAPTTP53GRM5LMNANPC1
SCHEMBL20116962 0.87 GRM5 (0.50) GPR119GRM5HTT
SCHEMBL20116528 0.86 USP30 (0.43) GPR119HDAC6PIK3CACKS1BSKP1
SCHEMBL20116967 0.82 GRM5 (0.49) GPR119GRM5NPC1
SCHEMBL20116416 0.81 USP30 (0.51) MAPTGPR119HTTTHRB
SCHEMBL20116425 0.81 USP30 (0.51) MAPTGPR119HTTTHRB
SCHEMBL17115026 0.81 HDAC4 (0.51) MAPTTP53GRM5LMNANPC1
SCHEMBL17115024 0.81 MAPT (0.56) MAPTGRM5LMNANPC1HTT
SCHEMBL17100788 0.80 MAPT (0.57) MAPTTP53GPR119LMNANPC1
SCHEMBL20676265 0.80 MAPT (0.42) MAPTTP53GRM5LMNAHTT

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-11873298-B2 Compounds and uses thereof JANSSEN PHARMACEUTICA NV (BE) 2024-01-16 US disclosed
US-11873298-B2 Compounds and uses thereof JANSSEN PHARMACEUTICA NV (BE) 2024-01-16 US disclosed
US-20200262828-A1 COMPOUNDS AND USES THEREOF JANSSEN PHARMACEUTICA NV (BE) 2020-08-20 US disclosed
WO-2019209948-A9 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS, INC. (US) 2020-01-02 WO disclosed
WO-2019018795-A1 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS (US) 2019-01-24 WO disclosed
WO-2018081167-A1 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS (US) 2018-05-03 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-11873298-B2 Compounds and uses thereof NLN, ACHE, CLN6 MAPT 22/4885TP53 4352/4885GPR119 2922/4885
US-20200262828-A1 COMPOUNDS AND USES THEREOF NLN, ACHE, CLN6 MAPT 22/4885TP53 4352/4885GPR119 2922/4885

“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.