SCHEMBL23866599

SCHEMBL23866599

CC(C)NC(=O)[C@H]1COCCN1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CTSC P53634 1/20 0.45
DPP7 Q9UHL4 1/20 0.38
CHRNB2 P17787 1/20 0.37
CHRNB4 P30926 1/20 0.37
CHRNA3 P32297 1/20 0.37
CHRNA7 P36544 1/20 0.37
CHRNA4 P43681 1/20 0.37
ACACB O00763 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
PKM P14618 1/20 0.35
SSTR4 P31391 1/20 0.34
CD274 Q9NZQ7 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
CHRM5 P08912 1/20 0.30
CHRM3 P20309 1/20 0.30
PSMB9 P28065 2/20 0.30

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
SCHEMBL27410795 1.00 CTSC (0.45) CTSCDPP7CHRNB2CHRNB4CHRNA3
SCHEMBL15572634 1.00 CTSC (0.45) CTSCDPP7CHRNB2CHRNB4CHRNA3
SCHEMBL27042548 0.83 CTSC (0.41) CTSCDPP7ACACBSMN1; SMN2SSTR4
SCHEMBL27042542 0.83 CTSC (0.41) CTSCDPP7ACACBSMN1; SMN2SSTR4
SCHEMBL1442858 0.80 CTSC (0.40) CTSCCHRNB2CHRNB4CHRNA3CHRNA7
SCHEMBL27410797 0.80 CTSC (0.40) CTSCCHRNB2CHRNB4CHRNA3CHRNA7
SCHEMBL1442856 0.80 CTSC (0.40) CTSCCHRNB2CHRNB4CHRNA3CHRNA7
SCHEMBL23866604 0.79 CTSC (0.40) CTSCACACBCD274
SCHEMBL25039138 0.77 DPP7 (0.46) CTSCDPP7CHRNB2CHRNB4CHRNA3
SCHEMBL20418559 0.77 DPP7 (0.46) CTSCDPP7CHRNB2CHRNB4CHRNA3

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-20210300940-A1 TLR7/8 ANTAGONISTS AND USES THEREOF MERCK PATENT GMBH (DE) 2021-09-30 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-20210300940-A1 TLR7/8 ANTAGONISTS AND USES THEREOF TLR7, TLR8, TLR9 CTSC 1498/4885DPP7 461/4885CHRNB2 2068/4885

“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.