SCHEMBL3940173

SCHEMBL3940173

Cc1ccoc1-c1c(C#N)c2ncnc(Cl)c2n1CCNC(=O)C(F)(F)F

nearest known ligand 0.31

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.31
ALDH1A1 P00352 3/20 0.31
GLA P06280 3/20 0.31
PKM P14618 3/20 0.31
HPGD P15428 3/20 0.31
POLB P06746 2/20 0.31
GAA P10253 2/20 0.31
P2RX3 P56373 1/20 0.31
LMNA P02545 1/20 0.30

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
SCHEMBL3936546 0.84 USP7 (0.34) KDM4EALDH1A1GLAPKMHPGD
SCHEMBL3936654 0.84 HTT (0.32) KDM4EALDH1A1GLAPKMHPGD
SCHEMBL3939388 0.83 CTSS (0.30) KDM4EALDH1A1GLAPKMHPGD
SCHEMBL3936568 0.83 KDM4E (0.32) KDM4EALDH1A1GLAPKMHPGD
SCHEMBL3943684 0.80 GSK3B (0.35) KDM4EALDH1A1HPGDP2RX3LMNA
SCHEMBL3944613 0.79 KDM4E (0.33) KDM4EALDH1A1GLAPKMHPGD
SCHEMBL13843279 0.78 KMT2A (0.34) KDM4EALDH1A1GLAPKMHPGD
SCHEMBL13843377 0.76 KDM4E (0.39) KDM4EALDH1A1GLAPKMHPGD
SCHEMBL13843280 0.73 KDM4E (0.34) KDM4EALDH1A1GLAPKMHPGD
SCHEMBL4328664 0.69 P2RX3 (0.30) P2RX3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7528140-B2 Substituted pyrrolo[3,2-d]pyrimidines as glycogen synthase kinase (GSK) inhibitors TEIJIN LIMITED (JP) 2009-05-05 US disclosed
US-7528140-B2 Substituted pyrrolo[3,2-d]pyrimidines as glycogen synthase kinase (GSK) inhibitors TEIJIN LIMITED (JP) 2009-05-05 US disclosed
US-20050277773-A1 Pyrrolopyrimidine derivatives TEIJIN LIMITED (JP) 2005-12-15 US disclosed
EP-1477489-A1 PYRROLOPYRIMIDINE DERIVATIVES TEIJIN LIMITED (JP) 2004-11-17 EP 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-20050277773-A1 Pyrrolopyrimidine derivatives GSK3B, GSK3A, GSKIP KDM4E 1378/4885ALDH1A1 2709/4885GLA 1782/4885

“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.