SCHEMBL19626290

SCHEMBL19626290

CC(C)(O)C#Cc1ccc2c(c1)c(-c1cnn(COCC[Si](C)(C)C)c1)cn2CC1CCOC1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CHUK O15111 11/20 0.52
CNR1 P21554 3/20 0.34
CNR2 P34972 3/20 0.34
PDE2A O00408 1/20 0.32
BRD4 O60885 3/20 0.31
RET P07949 1/20 0.31
KCNH2 Q12809 2/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
GRIN1 Q05586 1/20 0.31
GRIN2B Q13224 1/20 0.31
BRD2 P25440 1/20 0.31
BRD3 Q15059 1/20 0.31
BRDT Q58F21 1/20 0.31

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
SCHEMBL19626287 0.94 CHUK (0.50) CHUKBRD4
SCHEMBL19629514 0.91 CHUK (0.51) CHUKCNR1CNR2PDE2ABRD4
SCHEMBL16608407 0.88 CHUK (0.68) CHUK
SCHEMBL19626292 0.85 CHUK (0.44) CHUK
SCHEMBL19626294 0.85 CHUK (0.44) CHUK
SCHEMBL19629566 0.85 CHUK (0.49) CHUKBRD4
SCHEMBL19626295 0.84 CHUK (0.46) CHUK
SCHEMBL19626288 0.84 CHUK (0.48) CHUK
SCHEMBL19626275 0.84 CNR2 (0.41) CHUKCNR1CNR2KCNH2CYP1A2
SCHEMBL19626296 0.83 CHUK (0.40) CHUK

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-9981962-B2 Pyrazole derivatives as NIK inhibitors JANSSEN PHARMACEUTICA NV (BE) 2018-05-29 US disclosed
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 CHUK 32/4885CNR1 4263/4885CNR2 4366/4885

“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.