SCHEMBL7450431

SCHEMBL7450431

COc1n[c]ncc1-c1ncccn1

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CLK4 Q9HAZ1 2/20 0.35
DYRK1A Q13627 1/20 0.33
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
BTK Q06187 1/20 0.30
KMT2A Q03164 1/20 0.30
APLNR P35414 1/20 0.30
MAPT P10636 1/20 0.30
CASP1 P29466 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
SCHEMBL16568952 0.81 NPC1 (0.33) DYRK1ANPC1RAB9A
SCHEMBL7105966 0.73 SMPD3 (0.39) RAB9A
SCHEMBL7109276 0.73 IMPDH2 (0.33)
SCHEMBL20985611 0.73
SCHEMBL557964 0.71 CLK4 (0.35) CLK4DYRK1AKMT2AMAPT
SCHEMBL7456738 0.70 NPC1 (0.39) NPC1RAB9AKMT2AMAPTCASP1
SCHEMBL30961410 0.69 QPCT (0.44) CLK4DYRK1ANPC1RAB9AKMT2A
SCHEMBL150748 0.69 KMT2A (0.35) KMT2A
SCHEMBL558256 0.69
SCHEMBL1526561 0.67

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-20020019534-A1 Gem substituted hydroxamic acids PFIZER INC. 2002-02-14 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-20020019534-A1 Gem substituted hydroxamic acids MMP14, TOP2A, ADAMTS1 CLK4 4752/4885DYRK1A 4528/4885NPC1 2604/4885

“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.