SCHEMBL4497343

SCHEMBL4497343

Cc1nnc(-c2cnn3c(NC(C)C(C)C)c(-c4ccc(F)cc4Cl)c(Cl)nc23)[nH]1

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.31
MEN1 O00255 1/20 0.31
RAB9A P51151 1/20 0.31
KMT2A Q03164 1/20 0.31
GPR39 O43194 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
SCHEMBL4499369 0.84 RAB9A (0.37) HSD11B1MEN1RAB9AKMT2A
SCHEMBL4494475 0.81 KDM4E (0.31) MEN1KMT2A
SCHEMBL4510395 0.77 HSD11B1 (0.34) HSD11B1MEN1RAB9AKMT2A
SCHEMBL14360022 0.76 ALDH1A1 (0.37) MEN1KMT2A
SCHEMBL13606353 0.72 ADRA1A (0.32) RAB9AGPR39
SCHEMBL4507666 0.72 GSK3B (0.36)
SCHEMBL4692686 0.72 SCN10A (0.31)
SCHEMBL13606358 0.72 NISCH (0.33)
SCHEMBL13606355 0.71
SCHEMBL13606359 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7629294-B2 Pyrazolopyrimidines BAYER CROPSCIENCE LP (DE) 2009-12-08 US disclosed
US-20050187224-A1 Pyrazolopyrimidines BAYER CROPSCIENCE AG (DE) 2005-08-25 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-20050187224-A1 Pyrazolopyrimidines P2RX5, P2RX4, P2RX1 HSD11B1 3768/4885MEN1 2381/4885RAB9A 2226/4885

“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.