SCHEMBL3707429

SCHEMBL3707429

Cc1c(N)cccc1C(=O)c1c[nH]c2ncc(-c3ccccc3)cc12

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AXL P30530 10/20 0.61
GSK3B P49841 2/20 0.56
CAMKK2 Q96RR4 3/20 0.52
AAK1 Q2M2I8 1/20 0.52
PAK1 Q13153 4/20 0.49
SGK1 O00141 3/20 0.49
CDC7 O00311 1/20 0.49
PLK4 O00444 1/20 0.49
CHEK1 O14757 1/20 0.49
AURKA O14965 1/20 0.49
MAPK13 O15264 1/20 0.49
PDPK1 O15530 1/20 0.49
DYRK3 O43781 1/20 0.49
ROCK2 O75116 1/20 0.49
RPS6KA5 O75582 1/20 0.49
PRKD3 O94806 1/20 0.49
PAK4 O96013 1/20 0.49
CHEK2 O96017 1/20 0.49
ABL1 P00519 1/20 0.49
EGFR P00533 1/20 0.49

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
SCHEMBL3709344 0.89 DYRK1A (0.53) AXLAAK1PAK1PDPK1NTRK1
SCHEMBL3707426 0.89 AXL (0.61) AXLGSK3BCAMKK2AAK1PAK1
SCHEMBL450292 0.88 AXL (0.62) AXLCAMKK2AAK1PAK1SGK1
SCHEMBL3506675 0.87 AXL (0.58) AXLGSK3BCAMKK2AAK1PAK1
SCHEMBL3705101 0.84 BRAF (0.46) AXLAAK1PAK1PLK4AURKA
SCHEMBL298426 0.82 AXL (0.55) AXLGSK3BCAMKK2AAK1PAK1
SCHEMBL857844 0.81 NTRK1 (0.58) AXLCAMKK2AAK1PAK1NTRK1
SCHEMBL3506669 0.80 AXL (0.58) AXLGSK3BCAMKK2AAK1PAK1
SCHEMBL3709343 0.79 NEK1 (0.52) AXLGSK3BAAK1PAK1CDC7
SCHEMBL856967 0.79 AXL (0.59) AXLCAMKK2AAK1PAK1SGK1

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-20120122860-A1 SOLID FORMS OF SULFONAMIDES AND AMINO ACIDS PLEXXIKON, INC. 2012-05-17 US disclosed
WO-2010129570-A1 SOLID FORMS OF SULFONAMIDES AND AMINO ACIDS PLEXXIKON, INC. (US) 2010-11-11 WO 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-20120122860-A1 SOLID FORMS OF SULFONAMIDES AND AMINO ACIDS BRAF, RAF1, ARAF AXL 470/4885GSK3B 3250/4885CAMKK2 497/4885

“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.