SCHEMBL23170668

SCHEMBL23170668

CC(C)(C)n1ncc2cc(C#N)ccc21

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CYP11B2 P19099 4/20 0.52
▸ PGR P06401 1/20 0.41
▸ RET P07949 2/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ GLA P06280 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ TNKS O95271 2/20 0.36
▸ NR3C1 P04150 1/20 0.36
▸ CDC7 O00311 1/20 0.36
▸ KDM1A O60341 2/20 0.36
▸ CYP11B1 P15538 2/20 0.35
▸ CYP19A1 P11511 1/20 0.35
▸ CYP17A1 P05093 1/20 0.35
▸ IMPDH2 P12268 1/20 0.34
▸ IMPDH1 P20839 1/20 0.34
▸ CYP2A6 P11509 1/20 0.34
▸ GRM5 P41594 1/20 0.33
▸ CCR9 P51686 1/20 0.33

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
SCHEMBL30630539 0.78 KDM1A (0.51) CYP11B2PGRKDM1A
SCHEMBL7219801 0.78 KDM1A (0.51) CYP11B2PGRKDM1A
SCHEMBL13407783 0.75 NR3C1 (0.41) CYP11B2ALDH1A1NR3C1CYP11B1
SCHEMBL28813815 0.75 CYP11B2 (0.46) CYP11B2PGRKDM4EALDH1A1GLA
SCHEMBL26596978 0.75 CHEK1 (0.53) CYP11B2KDM4EALDH1A1GAANR3C1
SCHEMBL23162404 0.74 CACNA1H (0.52) CYP11B2PGRKDM1ACYP11B1CYP2A6
SCHEMBL5342173 0.72 CHEK1 (0.61) CYP11B2PGRTNKSCDC7KDM1A
SCHEMBL13263025 0.72 CYP11B2 (0.47) CYP11B2
SCHEMBL19915949 0.71 HCAR3 (0.54) CYP11B2RETKDM4EALDH1A1GLA
SCHEMBL31349698 0.71 HCAR3 (0.54) CYP11B2RETKDM4EALDH1A1GLA

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-11753381-B2 Inhibitors of receptor interacting protein kinase I for the treatment of disease BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2023-09-12 — — US disclosed
US-11753381-B2 Inhibitors of receptor interacting protein kinase I for the treatment of disease BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2023-09-12 — — US disclosed
US-20210094921-A1 INHIBITORS OF RECEPTOR INTERACTING PROTEIN KINASE I FOR THE TREATMENT OF DISEASE BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2021-04-01 — — 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-11753381-B2 Inhibitors of receptor interacting protein kinase I for the treatment of disease RIPK1, RIPK2, RIPK4 CYP11B2 4704/4885PGR 1410/4885RET 195/4885
US-20210094921-A1 INHIBITORS OF RECEPTOR INTERACTING PROTEIN KINASE I FOR THE TREATMENT OF DISEASE RIPK1, RIPK2, RIPK4 CYP11B2 4704/4885PGR 1410/4885RET 195/4885

“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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