SCHEMBL3733550

SCHEMBL3733550

O=c1[nH]c2cnccc2c(NC2CN3CCC2CC3)c1-c1nc2ccccc2[nH]1

nearest known ligand 0.86

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 15/20 0.86
PRKD3 O94806 3/20 0.72
PRKCG P05129 3/20 0.72
PRKCB P05771 3/20 0.72
PRKCA P17252 3/20 0.72
CCNA2 P20248 3/20 0.72
PRKCH P24723 3/20 0.72
CDK2 P24941 3/20 0.72
PRKCI P41743 3/20 0.72
PRKCE Q02156 3/20 0.72
PRKCQ Q04759 3/20 0.72
PRKCZ Q05513 3/20 0.72
PRKCD Q05655 3/20 0.72
PRKD1 Q15139 3/20 0.72
FGFR1 P11362 5/20 0.56
FLT1 P17948 2/20 0.56
PDGFRB P09619 3/20 0.52
KDR P35968 3/20 0.52
AURKA O14965 1/20 0.52

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
SCHEMBL3733547 1.00 CHEK1 (0.86) CHEK1PRKD3PRKCGPRKCBPRKCA
SCHEMBL3733543 1.00 CHEK1 (0.86) CHEK1PRKD3PRKCGPRKCBPRKCA
SCHEMBL3381807 0.93 CHEK1 (1.00) CHEK1PRKD3PRKCGPRKCBPRKCA
SCHEMBL3382255 0.93 CHEK1 (1.00) CHEK1PRKD3PRKCGPRKCBPRKCA
SCHEMBL3381730 0.93 CHEK1 (1.00) CHEK1PRKD3PRKCGPRKCBPRKCA
SCHEMBL14796246 0.86 CHEK1 (0.77) CHEK1PRKD3PRKCGPRKCBPRKCA
SCHEMBL14796040 0.86 CHEK1 (0.77) CHEK1PRKD3PRKCGPRKCBPRKCA
SCHEMBL14796445 0.86 CHEK1 (0.77) CHEK1PRKD3PRKCGPRKCBPRKCA
SCHEMBL3841380 0.86 CHEK1 (0.77) CHEK1PRKD3PRKCGPRKCBPRKCA
SCHEMBL3843161 0.86 CHEK1 (0.79) CHEK1PRKD3PRKCGPRKCBPRKCA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2573079-A2 Benzimidazole quinolinones and uses thereof Novartis Vaccines and Diagnostics, Inc. (US) 2013-03-27 EP disclosed
US-7825132-B2 Inhibition of FGFR3 and treatment of multiple myeloma NOVARTIS VACCINES AND DIAGNOSTICS, INC. (US) 2010-11-02 US disclosed
US-7825132-B2 Inhibition of FGFR3 and treatment of multiple myeloma NOVARTIS VACCINES AND DIAGNOSTICS, INC. (US) 2010-11-02 US disclosed
US-20090281100-A1 Benzimidazole quinolinones and uses thereof BARSANTI PAUL A 2009-11-12 US disclosed
US-7470709-B2 Benzimidazole quinolinones and uses thereof NOVARTIS VACCINES AND DIAGNOSTICS, INC. (US) 2008-12-30 US disclosed
US-7470709-B2 Benzimidazole quinolinones and uses thereof NOVARTIS VACCINES AND DIAGNOSTICS, INC. (US) 2008-12-30 US disclosed
US-20050261307-A1 Inhibition of FGFR3 and treatment of multiple myeloma CHIRON CORPORATION 2005-11-24 US disclosed
US-20050256157-A1 Combination therapy with CHK1 inhibitors CHIRON CORPORATION 2005-11-17 US disclosed
US-20050203101-A1 Benzimidazole quinolinones and uses thereof CHIRON CORPORATION 2005-09-15 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 (4 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-20050256157-A1 Combination therapy with CHK1 inhibitors CHEK1, CHEK2, RAD1 CHEK1 1/4885PRKD3 457/4885PRKCG 611/4885
US-20050261307-A1 Inhibition of FGFR3 and treatment of multiple myeloma FGFR3, FGFR1, FGFR2 CHEK1 2063/4885PRKD3 1017/4885PRKCG 2188/4885
US-20090281100-A1 Benzimidazole quinolinones and uses thereof GAA, ALPI, IL4I1 CHEK1 2358/4885PRKD3 3788/4885PRKCG 3175/4885
US-20050203101-A1 Benzimidazole quinolinones and uses thereof H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, TP53, PBRM1 CHEK1 154/4885PRKD3 3369/4885PRKCG 4063/4885

“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.