SCHEMBL3921730

SCHEMBL3921730

Fc1cc(-c2cnc(Nc3ccccc3)nc2)ccc1OCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK2 P24941 6/20 0.47
▸ CDK9 P50750 5/20 0.47
▸ LRRK2 Q5S007 5/20 0.46
▸ ERN1 O75460 1/20 0.46
▸ SLK Q9H2G2 3/20 0.44
▸ STK10 O94804 1/20 0.44
▸ CTSA P10619 1/20 0.43
▸ GFRA3 O60609 2/20 0.43
▸ RET P07949 2/20 0.43
▸ PRMT5 O14744 1/20 0.42
▸ SYK P43405 2/20 0.42
▸ PLK4 O00444 1/20 0.42
▸ AURKA O14965 1/20 0.42
▸ PDPK1 O15530 1/20 0.42
▸ JAK2 O60674 1/20 0.42
▸ PRKD3 O94806 1/20 0.42
▸ MAP4K4 O95819 1/20 0.42
▸ NTRK1 P04629 1/20 0.42
▸ INSR P06213 1/20 0.42
▸ LCK P06239 1/20 0.42

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
SCHEMBL3913833 0.93 ERN1 (0.46) CDK2CDK9LRRK2ERN1SLK
SCHEMBL2859316 0.83 PDGFRB (0.51) CDK2SLKGFRA3RETSYK
SCHEMBL8614216 0.82 ERN1 (0.49) LRRK2ERN1CTSAPRMT5MAP4K4
SCHEMBL8615551 0.82 ERN1 (0.49) LRRK2ERN1CTSAPRMT5MAP4K4
SCHEMBL27756247 0.81 ERN1 (0.51) LRRK2ERN1CTSAPRMT5MAP4K4
SCHEMBL3920789 0.81 LRRK2 (0.42) CDK2CDK9LRRK2ERN1SLK
SCHEMBL24363273 0.80 ERN1 (0.50) LRRK2ERN1CTSAPRMT5LMNA
SCHEMBL8616560 0.79 ERN1 (0.49) LRRK2ERN1CTSAPRMT5MAP4K4
SCHEMBL8613062 0.78 ERN1 (0.48) ERN1CTSAPRMT5MAP4K4
SCHEMBL8612029 0.77 ERN1 (0.52) LRRK2ERN1CTSALMNAL3MBTL1

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-20110053931-A1 QUINOLINE COMPOUNDS AND METHODS OF USE GAUDINO JOHN 2011-03-03 — — US disclosed
EP-2032538-A2 QUINOLINE COMPOUNDS AND METHODS OF USE Array Biopharma, Inc. (US) 2009-03-11 — — EP disclosed
WO-2007146824-A2 QUINOLINE COMPOUNDS AND METHODS OF USE ARRAY BIOPHARMA INC. (US) 2007-12-21 — — 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-20110053931-A1 QUINOLINE COMPOUNDS AND METHODS OF USE TK1, ABL1, ROR1 CDK2 9/4885CDK9 416/4885LRRK2 1038/4885

“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.

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