SCHEMBL17981685

SCHEMBL17981685

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

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ NR3C1 P04150 15/20 0.41
▸ MTNR1A P48039 1/20 0.37
▸ NR4A2 P43354 1/20 0.36
▸ BRD4 O60885 1/20 0.35

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
SCHEMBL17963128 0.85 NR3C1 (0.37) KMT2AKDM4EALDH1A1NR3C1
SCHEMBL17981707 0.83 KMT2A (0.44) KMT2AKDM4EALDH1A1NR3C1
SCHEMBL17981692 0.80 KDM4E (0.41) KMT2AKDM4EALDH1A1NR3C1
SCHEMBL17980463 0.79 NR3C1 (0.62) NR3C1
SCHEMBL20413660 0.78 NR3C1 (0.55) NR3C1
SCHEMBL20413792 0.76 NR3C1 (0.30) KDM4EALDH1A1NR3C1
SCHEMBL17980473 0.76 NR3C1 (0.64) NR3C1
SCHEMBL17980466 0.75 NR3C1 (0.66) NR3C1
SCHEMBL20413794 0.74 MTNR1A (0.31) MTNR1A
SCHEMBL17963076 0.71 MTNR1A (0.49) KDM4EMTNR1ANR4A2BRD4

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 5 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-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
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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