SCHEMBL864754

SCHEMBL864754

CNc1nc2c(Cl)cccc2cc1C(C)NC(=O)O

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 3/20 0.38
GPR139 Q6DWJ6 1/20 0.38
CTSA P10619 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
PDE2A O00408 1/20 0.36
CXCL8 P10145 1/20 0.35
NR4A2 P43354 1/20 0.35
YTHDC1 Q96MU7 1/20 0.35
USP9X Q93008 1/20 0.34

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
SCHEMBL5302 0.86 GPR139 (0.39) PIK3CDGPR139CTSAL3MBTL1PDE2A
SCHEMBL863999 0.85 GPR139 (0.38) PIK3CDGPR139CTSAL3MBTL1USP9X
SCHEMBL864285 0.82 MAT2A (0.39) PIK3CDGPR139CTSAL3MBTL1PDE2A
SCHEMBL863538 0.82 KCNJ5 (0.42) PIK3CDGPR139CTSA
SCHEMBL864320 0.82 KCNJ5 (0.42) PIK3CDGPR139CTSA
SCHEMBL865348 0.82 KDM4E (0.45) PIK3CDGPR139CTSA
SCHEMBL863539 0.82 KCNJ5 (0.42) PIK3CDGPR139CTSA
SCHEMBL865362 0.80 PIP4K2C (0.42) PIK3CD
SCHEMBL864954 0.79 PIK3CD (0.46) PIK3CD
SCHEMBL863898 0.79 USP9X (0.36) PIK3CDGPR139CTSAL3MBTL1NR4A2

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
EP-2396315-B1 QUINOLINE DERIVATIVES AS PI3K KINASE INHIBITORS UCB BIOPHARMA SPRL (BE) 2016-08-31 EP disclosed
US-8513284-B2 Fused pyridine and pyrazine derivatives as kinase inhibitors UCB PHARMA, S.A. (BE) 2013-08-20 US disclosed
US-20120077815-A1 Fused Pyridine And Pyrazine Derivatives As Kinase Inhibitors UCB PHARMA S.A. (BE) 2012-03-29 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-20120077815-A1 Fused Pyridine And Pyrazine Derivatives As Kinase Inhibitors PDPK1, PDXK, PIK3CA PIK3CD 14/4885GPR139 2123/4885CTSA 3544/4885

“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.