SCHEMBL11903365

SCHEMBL11903365

COc1ccc(CNc2cc3c(N)nc(-c4ccc(OCc5ccccn5)c(Cl)c4)nc3cn2)cc1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SYK P43405 10/20 0.44
PDE5A O76074 5/20 0.42
PDE10A Q9Y233 1/20 0.41
AURKB Q96GD4 2/20 0.41
INCENP Q9NQS7 2/20 0.41
CLK4 Q9HAZ1 1/20 0.40
MEN1 O00255 1/20 0.40
LMNA P02545 1/20 0.40
KMT2A Q03164 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL11903347 0.87 FYN (0.42) CLK4LMNA
SCHEMBL11902826 0.84 CLK4 (0.53) CLK4
SCHEMBL17476604 0.82 EGFR (0.45) CLK4
SCHEMBL11902828 0.81 SYK (0.46) SYKAURKBINCENPMEN1KMT2A
SCHEMBL11903033 0.80 CLK4 (0.46) CLK4
SCHEMBL2250614 0.79 NOS3 (0.44) SYKAURKBINCENPMEN1LMNA
SCHEMBL11903072 0.78 CLK4 (0.44) CLK4
SCHEMBL11903385 0.77 EGFR (0.47) CLK4
SCHEMBL2252552 0.76 SYK (0.55) SYKAURKBINCENPMEN1KMT2A
SCHEMBL868406 0.75 EGFR (0.45) CLK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160031877-A1 KINASE INHIBITORS, PRODRUG FORMS THEREOF AND THEIR USE IN THERAPY AUCKLAND UNISERVICES LIMITED (NZ) 2016-02-04 US disclosed
US-9101632-B2 Kinase inhibitors, prodrug forms thereof and their use in therapy AUCKLAND UNISERVICES LIMITED (NZ) 2015-08-11 US disclosed
US-20120202832-A1 KINASE INHIBITORS, PRODRUG FORMS THEREOF AND THEIR USE IN THERAPY AUCKLAND UNISERVICES LIMITED (NZ) 2012-08-09 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 (2 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-20160031877-A1 KINASE INHIBITORS, PRODRUG FORMS THEREOF AND THEIR USE IN THERAPY ERBB2, MAP3K3, ERBB3 SYK 716/4885PDE5A 2324/4885PDE10A 2834/4885
US-20120202832-A1 KINASE INHIBITORS, PRODRUG FORMS THEREOF AND THEIR USE IN THERAPY ERBB2, MAP3K3, MAP3K19 SYK 674/4885PDE5A 2442/4885PDE10A 2866/4885

“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.