SCHEMBL2205672

SCHEMBL2205672

COc1ccc2c(Nc3cnc(N)nc3)ccnc2c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAK O14976 9/20 0.65
▸ RIPK2 O43353 4/20 0.65
▸ COQ8A Q8NI60 4/20 0.65
▸ NLK Q9UBE8 4/20 0.65
▸ HTR1A P08908 2/20 0.59
▸ ADRA1D P25100 2/20 0.59
▸ ADRA1A P35348 2/20 0.59
▸ ADRA1B P35368 2/20 0.59
▸ FERMT2 Q96AC1 1/20 0.57
▸ HTT P42858 1/20 0.53
▸ TGFBR1 P36897 3/20 0.51
▸ EGFR P00533 2/20 0.50
▸ PDGFRA P16234 1/20 0.47
▸ KDR P35968 1/20 0.47
▸ CLK2 P49760 1/20 0.47
▸ IRAK1 P51617 1/20 0.47
▸ NEK4 P51957 1/20 0.47
▸ MAP4K2 Q12851 1/20 0.47
▸ HIPK4 Q8NE63 1/20 0.47
▸ SRPK1 Q96SB4 1/20 0.47

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
SCHEMBL19633676 0.86 GAK (0.68) GAKRIPK2COQ8ANLKHTR1A
SCHEMBL25466634 0.82 GAK (0.70) GAKRIPK2COQ8ANLKHTR1A
Hydrochloric Acid SCHEMBL9073104 0.81 GAK (0.58) GAKRIPK2COQ8ANLKHTR1A
SCHEMBL30420525 0.81 HTT (0.70) GAKRIPK2COQ8ANLKHTR1A
SCHEMBL19633637 0.81 GAK (0.64) GAKRIPK2COQ8ANLKHTR1A
SCHEMBL19633703 0.80 GAK (0.60) GAKRIPK2COQ8ANLKHTR1A
SCHEMBL25466706 0.80 GAK (0.67) GAKRIPK2COQ8ANLKHTR1A
SCHEMBL30420470 0.80 GAK (0.67) GAKRIPK2COQ8ANLKHTR1A
SCHEMBL21121679 0.80 HTT (0.64) GAKRIPK2COQ8ANLKHTR1A
SCHEMBL21121509 0.80 HTT (0.64) GAKRIPK2COQ8ANLKHTR1A

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 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140336182-A1 Aurora Kinase Modulators and Method of Use AMGEN INC (US) 2014-11-13 — — US disclosed
US-20140336182-A1 Aurora Kinase Modulators and Method of Use AMGEN INC (US) 2014-11-13 — — US disclosed
US-20140336182-A1 Aurora Kinase Modulators and Method of Use AMGEN INC (US) 2014-11-13 — — US disclosed
EP-2137177-B1 AURORA KINASE MODULATORS AND METHOD OF USE AMGEN INC (US) 2014-05-07 — — EP disclosed
EP-2137177-B1 AURORA KINASE MODULATORS AND METHOD OF USE AMGEN INC (US) 2014-05-07 — — EP disclosed
US-8557816-B2 Aurora kinase modulators and method of use AMGEN INC. (US) 2013-10-15 — — US disclosed
US-8557816-B2 Aurora kinase modulators and method of use AMGEN INC. (US) 2013-10-15 — — US disclosed
US-8557816-B2 Aurora kinase modulators and method of use AMGEN INC. (US) 2013-10-15 — — US disclosed
US-20120122847-A1 AURORA KINASE MODULATORS AND METHOD OF USE AMGEN INC. (US) 2012-05-17 — — US disclosed
US-20120122847-A1 AURORA KINASE MODULATORS AND METHOD OF USE AMGEN INC. (US) 2012-05-17 — — US disclosed
US-20100280008-A1 AURORA KINASE MODULATORS AND METHOD OF USE AMGEN INC. (US) 2010-11-04 — — US disclosed
US-7776857-B2 Aurora kinase modulators and method of use AMGEN INC. (US) 2010-08-17 — — US disclosed
US-7776857-B2 Aurora kinase modulators and method of use AMGEN INC. (US) 2010-08-17 — — US disclosed
US-7776857-B2 Aurora kinase modulators and method of use AMGEN INC. (US) 2010-08-17 — — US disclosed
EP-2137177-A2 AURORA KINASE MODULATORS AND METHOD OF USE Amgen, Inc (US) 2009-12-30 — — EP disclosed
US-20090069297-A1 Aurora kinase modulators and method of use AMGEN INC. (US) 2009-03-12 — — US disclosed
US-20090069297-A1 Aurora kinase modulators and method of use AMGEN INC. (US) 2009-03-12 — — US disclosed
US-20090069297-A1 Aurora kinase modulators and method of use AMGEN INC. (US) 2009-03-12 — — US disclosed
WO-2008124083-A2 AURORA KINASE MODULATORS AND METHOD OF USE AMGEN INC. (US) 2008-10-16 — — WO disclosed
WO-2008124083-A2 AURORA KINASE MODULATORS AND METHOD OF USE AMGEN INC. (US) 2008-10-16 — — 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 (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-20140336182-A1 Aurora Kinase Modulators and Method of Use AURKC, AURKA, CDK1 GAK 62/4885RIPK2 533/4885COQ8A 290/4885
US-20090069297-A1 Aurora kinase modulators and method of use AURKC, AURKA, CDK1 GAK 62/4885RIPK2 533/4885COQ8A 290/4885
US-20100280008-A1 AURORA KINASE MODULATORS AND METHOD OF USE AURKC, AURKA, CDK1 GAK 62/4885RIPK2 533/4885COQ8A 290/4885
US-20120122847-A1 AURORA KINASE MODULATORS AND METHOD OF USE AURKC, AURKA, CDK1 GAK 62/4885RIPK2 533/4885COQ8A 290/4885

“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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