SCHEMBL17981707

SCHEMBL17981707

COC(=O)c1cnc2c(c(C)cn2C)c1Cl

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 1/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ NR3C1 P04150 17/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL17963208 0.84 KDM4E (0.43) KMT2AKDM4EALDH1A1NR3C1SMN1; SMN2
SCHEMBL17981692 0.83 KDM4E (0.41) KMT2AKDM4EALDH1A1NR3C1
SCHEMBL17981685 0.83 KMT2A (0.42) KMT2AKDM4EALDH1A1NR3C1
SCHEMBL20413602 0.81 NR3C1 (0.69) KDM4EALDH1A1NR3C1
SCHEMBL20413411 0.79 NR3C1 (0.70) NR3C1
SCHEMBL20413394 0.78 NR3C1 (0.71) KMT2AKDM4EALDH1A1NR3C1SMN1; SMN2
SCHEMBL17980464 0.77 NR3C1 (0.67) NR3C1
SCHEMBL20413370 0.77 NR3C1 (0.59) NR3C1
SCHEMBL20413603 0.76 NR3C1 (0.69) KDM4EALDH1A1NR3C1SMN1; SMN2
SCHEMBL20413366 0.76 NR3C1 (0.69) KDM4ENR3C1

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-10272074-B2 Inhibitors of glucocorticoid receptor translocation Sanford Burnham Prebys Medical Discovery Institute (US) 2019-04-30 — — US disclosed
US-20180207140-A1 Pyrazolopyrimidines as Inhibitors of Glucocorticoid Receptor Translocation Sanford Burnham Prebys Medical Discovery Institute 2018-07-26 — — US disclosed
WO-2016123392-A2 PYRAZOLOPYRIMIDINES AS INHIBITORS OF GLUCOCORTICOID RECEPTOR TRANSLOCATION SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE (US) 2016-08-04 — — 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-20180207140-A1 Pyrazolopyrimidines as Inhibitors of Glucocorticoid Receptor Translocation NR3C1, NR3C2, GRK3 KMT2A 3251/4885KDM4E 3498/4885ALDH1A1 3369/4885
US-10272074-B2 Inhibitors of glucocorticoid receptor translocation NR3C1, NR3C2, GRK3 KMT2A 3527/4885KDM4E 3499/4885ALDH1A1 3958/4885

“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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