SCHEMBL18930779

SCHEMBL18930779

CC(C)(C)OC(=O)N[C@H]1CC[C@H](NC(=O)[C@@H](Cc2ccc(C#N)cc2)NC(=O)OCc2ccccc2)CC1

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CTSL P07711 9/20 0.55
CTSS P25774 7/20 0.55
CTSB P07858 7/20 0.55
CTSK P43235 5/20 0.55
P2RX7 Q99572 1/20 0.54
TACR1 P25103 1/20 0.53
SCN9A Q15858 1/20 0.48

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
SCHEMBL18920632 1.00 CTSL (0.55) CTSLCTSSCTSBCTSKP2RX7
SCHEMBL21144825 1.00 CTSL (0.55) CTSLCTSSCTSBCTSKP2RX7
SCHEMBL7983717 0.84 CTSS (0.55) CTSLCTSSCTSBCTSKSCN9A
SCHEMBL7983723 0.84 CTSS (0.55) CTSLCTSSCTSBCTSKSCN9A
SCHEMBL3002994 0.82 CTSL (0.55) CTSLCTSSCTSBCTSKTACR1
SCHEMBL3002997 0.82 CTSL (0.55) CTSLCTSSCTSBCTSKTACR1
SCHEMBL21169918 0.81 CTSS (0.52) CTSLCTSSCTSBCTSKSCN9A
SCHEMBL7367771 0.79 BCL2 (0.60) CTSLCTSSCTSBCTSKSCN9A
SCHEMBL21144920 0.79 DRD2 (0.48) CTSLCTSSCTSBCTSK
SCHEMBL18930483 0.79 DRD2 (0.48) CTSLCTSSCTSBCTSK

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10654818-B2 Furane derivatives as inhibitors of ATAD2 BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2020-05-19 US disclosed
EP-3383865-B1 FURANE DERIVATIVES AS INHIBITORS OF ATAD2 Bayer Pharma AG (DE) 2020-01-29 EP disclosed
US-20190218196-A1 FURANE DERIVATIVES AS INHIBITORS OF ATAD2 BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2019-07-18 US disclosed
WO-2017093272-A1 FURANE DERIVATIVES AS INHIBITORS OF ATAD2 BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2017-06-08 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-20190218196-A1 FURANE DERIVATIVES AS INHIBITORS OF ATAD2 ATAD2, ATAD2B, TAF1L CTSL 4617/4885CTSS 3972/4885CTSB 3425/4885
US-10654818-B2 Furane derivatives as inhibitors of ATAD2 ATAD2, ATAD2B, TAF1L CTSL 4617/4885CTSS 3972/4885CTSB 3425/4885

“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.