SCHEMBL12480237

SCHEMBL12480237

CC(=O)c1cn(CC(=O)OC(C)(C)C)c2ncncc12

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CFD P00746 1/20 0.39
NTRK1 P04629 16/20 0.37
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 1/20 0.36
JAK2 O60674 1/20 0.33
JAK1 P23458 1/20 0.33
JAK3 P52333 1/20 0.33
LMNA P02545 1/20 0.32
TSHR P16473 1/20 0.32
HTT P42858 1/20 0.32

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
SCHEMBL12480375 0.84 KDM4E (0.37) NTRK1KDM4EALDH1A1JAK2JAK1
SCHEMBL19410173 0.82 ALDH1A1 (0.39) NTRK1KDM4EALDH1A1JAK2JAK1
SCHEMBL12480545 0.82 CFD (0.42) CFDNTRK1KDM4EALDH1A1LMNA
SCHEMBL27927321 0.81 CFD (0.36) CFDNTRK1ALDH1A1
SCHEMBL25206447 0.80 P2RX7 (0.38) NTRK1KDM4EALDH1A1JAK2JAK1
SCHEMBL19420845 0.78 KDM4E (0.33) NTRK1KDM4EALDH1A1JAK2JAK1
SCHEMBL19427004 0.78 ALDH1A1 (0.36) NTRK1KDM4EALDH1A1LMNA
SCHEMBL19410165 0.76 JAK2 (0.33) NTRK1KDM4EALDH1A1JAK2JAK1
SCHEMBL19410241 0.76 PTGS2 (0.33) NTRK1KDM4EALDH1A1JAK2JAK1
SCHEMBL15540870 0.76 CFD (0.42) CFDKDM4EALDH1A1LMNATSHR

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
EP-2661433-B1 INDOLE COMPOUNDS OR ANALOGUES THEREOF USEFUL FOR THE TREATMENT OF AGE-RELATED MACULAR DEGENERATION (AMD) NOVARTIS AG (CH) 2017-08-16 EP disclosed
US-9085555-B2 Complement pathway modulators and uses thereof NOVARTIS AG (CH) 2015-07-21 US disclosed
EP-2661433-A1 INDOLE COMPOUNDS OR ANALOGUES THEREOF USEFUL FOR THE TREATMENT OF AGE-RELATED MACULAR DEGENERATION (AMD) Novartis AG (CH) 2013-11-13 EP disclosed
US-20120295884-A1 Complement pathway modulators and uses thereof NOVARTIS AG (CH) 2012-11-22 US disclosed
WO-2012093101-A1 INDOLE COMPOUNDS OR ANALOGUES THEREOF USEFUL FOR THE TREATMENT OF AGE-RELATED MACULAR DEGENERATION (AMD) NOVARTIS AG (CH) 2012-07-12 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 (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-20120295884-A1 Complement pathway modulators and uses thereof C5, C3AR1, C9 CFD 9/4885NTRK1 3854/4885KDM4E 4092/4885

“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.