SCHEMBL22358024

SCHEMBL22358024

CC(C)n1ncc2ccc(-c3noc(N4C[C@H]5CN(C(=O)OC(C)(C)C)C[C@H]5C4)n3)cc21

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 5/20 0.40
HDAC4 P56524 4/20 0.38
OPRM1 P35372 1/20 0.38
OPRD1 P41143 1/20 0.38
OPRK1 P41145 1/20 0.38
OGFRL1 Q5TC84 1/20 0.38
HDAC6 Q9UBN7 5/20 0.37
LRRK2 Q5S007 1/20 0.37
LMNA P02545 3/20 0.36
MAPT P10636 3/20 0.36
HDAC8 Q9BY41 2/20 0.36
KCNK3 O14649 1/20 0.36
KCNK9 Q9NPC2 1/20 0.36
PDE10A Q9Y233 2/20 0.36
HDAC1 Q13547 1/20 0.35
NPC1 O15118 1/20 0.35
HTT P42858 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
SCHEMBL20116672 1.00 GPR119 (0.40) GPR119HDAC4OPRM1OPRD1OPRK1
SCHEMBL20116477 0.91 MAPT (0.39) LMNAMAPTNPC1HTT
SCHEMBL20116239 0.89 MAPT (0.36) LMNAMAPTNPC1HTT
SCHEMBL22357990 0.89 MAPT (0.46) GPR119HDAC4LRRK2LMNAMAPT
SCHEMBL20116656 0.86 S1PR1 (0.36) LMNAMAPTHDAC8NPC1HTT
SCHEMBL20116481 0.86 S1PR1 (0.36) LMNAMAPTHDAC8NPC1HTT
SCHEMBL22358283 0.85 FAAH (0.46) GPR119
SCHEMBL20116732 0.85 SCD5 (0.43) GPR119HDAC4LRRK2LMNAMAPT
SCHEMBL20116953 0.84 GPR119 (0.40) GPR119HDAC4HDAC6LRRK2HDAC8
SCHEMBL22358432 0.83 PIK3CD (0.34) LMNAMAPTNPC1

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 3 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

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 2922/4885HDAC4 496/4885OPRM1 2537/4885
US-20200262828-A1 COMPOUNDS AND USES THEREOF NLN, ACHE, CLN6 GPR119 2922/4885HDAC4 496/4885OPRM1 2537/4885

“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.