SCHEMBL20116720

SCHEMBL20116720

CC(C)(C)OC(=O)N1CCN(c2nc(-c3ccc4cnn(C5CCC5)c4c3)no2)CC1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 5/20 0.50
MAPT P10636 7/20 0.45
LMNA P02545 4/20 0.45
NPC1 O15118 1/20 0.45
HTT P42858 1/20 0.45
HDAC4 P56524 4/20 0.44
LRRK2 Q5S007 1/20 0.44
TP53 P04637 3/20 0.44
PIK3CA P42336 1/20 0.43
MTOR P42345 1/20 0.43
PIK3CG P48736 1/20 0.43
ATR Q13535 1/20 0.43
AURKB Q96GD4 1/20 0.43
THRB P10828 1/20 0.42
HDAC6 Q9UBN7 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL20117118 0.91 GPR119 (0.46) GPR119MAPTLMNANPC1HTT
SCHEMBL20116064 0.91 GPR119 (0.46) GPR119MAPTLMNANPC1HTT
SCHEMBL20116524 0.90 GPR119 (0.46) GPR119MAPTLMNANPC1HTT
SCHEMBL20116520 0.90 LRRK2 (0.45) GPR119MAPTLMNANPC1HTT
SCHEMBL20116370 0.87 MAPT (0.51) GPR119MAPTLMNANPC1HTT
SCHEMBL20116323 0.86 GPR119 (0.52) GPR119HDAC4PIK3CAMTORPIK3CG
SCHEMBL22357990 0.84 MAPT (0.46) GPR119MAPTLMNANPC1HTT
SCHEMBL22358247 0.82 GPR119 (0.54) GPR119LMNAHDAC4PIK3CAMTOR
SCHEMBL20116033 0.82 MAPT (0.50) MAPTLMNANPC1HTTTP53
SCHEMBL20116058 0.81 MAPT (0.49) MAPTLMNANPC1HTTTP53

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 GPR119 2922/4885MAPT 22/4885LMNA 1966/4885
US-20200262828-A1 COMPOUNDS AND USES THEREOF NLN, ACHE, CLN6 GPR119 2922/4885MAPT 22/4885LMNA 1966/4885

“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.