SCHEMBL17546303

SCHEMBL17546303

CNC(=O)N1CC(C#N)C1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.48
▸ HSD11B1 P28845 1/20 0.31
▸ HDAC2 Q92769 1/20 0.31
▸ MCL1 Q07820 1/20 0.31
▸ JAK2 O60674 2/20 0.30
▸ JAK1 P23458 2/20 0.30
▸ JAK3 P52333 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
SCHEMBL17546302 0.85 POLB (0.47) POLBJAK2JAK1JAK3
SCHEMBL17546299 0.82 POLB (0.44) POLB
SCHEMBL19014557 0.80 POLB (0.56) POLB
SCHEMBL24158934 0.79 HSD11B1 (0.31) HSD11B1
SCHEMBL30778397 0.79 POLB (0.48) POLBHDAC2
SCHEMBL19249275 0.79 DPP4 (0.46) JAK2JAK1JAK3
SCHEMBL24568323 0.76 DPP4 (0.36) JAK2JAK1JAK3
SCHEMBL8141531 0.76 — —
SCHEMBL17546300 0.75 POLB (0.43) POLBMCL1JAK2JAK1JAK3
SCHEMBL12521943 0.73 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170233371-A1 RORC2 INHIBITORS AND METHODS OF USE THEREOF PFIZER INC. (US) 2017-08-17 — — US disclosed
US-20160046597-A1 RORC2 INHIBITORS AND METHODS OF USE THEREOF PFIZER (US) 2016-02-18 — — 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-20160046597-A1 RORC2 INHIBITORS AND METHODS OF USE THEREOF RORC, RORB, RORA POLB 4110/4885HSD11B1 52/4885HDAC2 191/4885
US-20170233371-A1 RORC2 INHIBITORS AND METHODS OF USE THEREOF RORC, RORB, RORA POLB 4110/4885HSD11B1 52/4885HDAC2 191/4885

“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.

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