SCHEMBL21396420

SCHEMBL21396420

CC(C)(CCSc1nc2c(=O)[nH]c(N)nc2n1C1OC2COPOC2C1O)OCC(C)(C)Sc1nc2c(=O)[nH]c(N)nc2n1C[C@@H](O)C1OP(O)OCC1O

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.33
BLM P54132 1/20 0.33
PMP22 Q01453 1/20 0.33
TSHR P16473 1/20 0.33
NFKB1 P19838 1/20 0.33
PDE4A P27815 3/20 0.31
PDE4B Q07343 3/20 0.31
PDE4C Q08493 3/20 0.31
PDE4D Q08499 3/20 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
SCHEMBL21396432 0.77 MAPT (0.37) MAPTBLMPMP22TSHRNFKB1
SCHEMBL21396369 0.77 TDP1 (0.40)
SCHEMBL21396507 0.74 MAPT (0.31) MAPTBLMPMP22TSHRNFKB1
SCHEMBL25929765 0.72 MAPT (0.45) MAPTBLMPMP22TSHRNFKB1
SCHEMBL21396418 0.71 MAPT (0.39) MAPTBLMPMP22TSHRNFKB1
SCHEMBL21396384 0.71 TLR7 (0.35) MAPT
SCHEMBL25929055 0.70 MAPT (0.46) MAPTBLMPMP22TSHRNFKB1
SCHEMBL25928905 0.70 PDE4A (0.47) MAPTBLMPMP22TSHRNFKB1
SCHEMBL25929197 0.69 MAPT (0.44) MAPTBLMPMP22TSHRNFKB1
SCHEMBL25928883 0.69 MAPT (0.41) MAPTBLMPMP22TSHRNFKB1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190292214-A1 NEW EQUATORIALLY MODIFIED POLYMER LINKED MULTIMERS OF GUANOSINE-3', 5'-CYCLIC MONOPHOSPHATES MIRECA MEDICINES GMBH (DE) 2019-09-26 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-20190292214-A1 NEW EQUATORIALLY MODIFIED POLYMER LINKED MULTIMERS OF GUANOSINE-3', 5'-CYCLIC MONOPHOSPHATES PDE7A, PRKG1, PDE4C MAPT 4419/4885BLM 2555/4885PMP22 4376/4885

“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.