SCHEMBL19626259

SCHEMBL19626259

CC(C)(C)OC(=O)N1CC(n2cc(-c3cn(COCC[Si](C)(C)C)nc3Cl)c3cc(Br)c(F)cc32)C1

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
IL1B P01584 3/20 0.34
P2RX7 Q99572 3/20 0.34
IDO1 P14902 2/20 0.34
KLKB1 P03952 1/20 0.31
USP30 Q70CQ3 1/20 0.31
CCNT1 O60563 1/20 0.31
CDK9 P50750 1/20 0.31
SCN9A Q15858 1/20 0.30
BTK Q06187 1/20 0.30
KDM1A O60341 1/20 0.30
RET P07949 1/20 0.30
GPR119 Q8TDV5 1/20 0.30
TGFBR1 P36897 1/20 0.30
KAT5 Q92993 1/20 0.30
KAT8 Q9H7Z6 1/20 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
SCHEMBL19626249 0.93 KDM1A (0.35) IL1BP2RX7IDO1SCN9ABTK
SCHEMBL19626265 0.93 PRKCG (0.37) IL1BP2RX7IDO1SCN9AKDM1A
SCHEMBL19629423 0.90 IL1B (0.33) IL1BP2RX7IDO1USP30CCNT1
SCHEMBL19629472 0.84 SCN9A (0.36) IL1BP2RX7SCN9ABTKKDM1A
SCHEMBL19629574 0.83 GPR119 (0.38) SCN9AKDM1AGPR119
SCHEMBL19626260 0.82 MAP3K14 (0.39) KDM1A
SCHEMBL19626246 0.82 MAP3K14 (0.33) KDM1A
SCHEMBL16608659 0.80 PRKCG (0.37) KDM1AGPR119
SCHEMBL19626258 0.77 DGAT1 (0.34)
SCHEMBL16608649 0.74 RET (0.35) IL1BP2RX7KLKB1USP30RET

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-9981962-B2 Pyrazole derivatives as NIK inhibitors JANSSEN PHARMACEUTICA NV (BE) 2018-05-29 US disclosed
US-20170334900-A1 NEW PYRAZOLE DERIVATIVES AS NIK INHIBITORS ARGENTA DISCOVERY 2009 LIMITED (GB) 2017-11-23 US disclosed
US-20170334900-A1 NEW PYRAZOLE DERIVATIVES AS NIK INHIBITORS ARGENTA DISCOVERY 2009 LIMITED (GB) 2017-11-23 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-20170334900-A1 NEW PYRAZOLE DERIVATIVES AS NIK INHIBITORS MAP3K14, MAP3K15, MAP3K21 IL1B 362/4885P2RX7 2310/4885IDO1 676/4885

“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.