SCHEMBL1296690

SCHEMBL1296690

CC(C)n1nc(-c2cc3ccc(O)cc3[nH]2)c2c(N)ncnc21

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 12/20 0.84
▸ SRC P12931 12/20 0.84
▸ ABL1 P00519 10/20 0.84
▸ PIK3CD O00329 9/20 0.84
▸ PIK3CG P48736 9/20 0.84
▸ RET P07949 8/20 0.84
▸ EGFR P00533 7/20 0.84
▸ HCK P08631 7/20 0.84
▸ PIK3CA P42336 7/20 0.84
▸ PIK3CB P42338 7/20 0.84
▸ MTOR P42345 7/20 0.84
▸ EPHB4 P54760 7/20 0.84
▸ PRKDC P78527 7/20 0.84
▸ PI4KB Q9UBF8 5/20 0.84
▸ BMPR1B O00238 1/20 0.84
▸ PLK4 O00444 1/20 0.84
▸ PIK3C2B O00750 1/20 0.84
▸ CASK O14936 1/20 0.84
▸ GAK O14976 1/20 0.84
▸ EPHB6 O15197 1/20 0.84

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
SCHEMBL298922 0.92 SRC (1.00) KDRSRCABL1PIK3CDPIK3CG
SCHEMBL29454801 0.92 SRC (1.00) KDRSRCABL1PIK3CDPIK3CG
SCHEMBL21082533 0.88 RET (0.79) KDRSRCABL1PIK3CDPIK3CG
SCHEMBL19464200 0.87 RET (1.00) KDRSRCABL1PIK3CDPIK3CG
SCHEMBL12422335 0.86 RET (0.81) KDRSRCABL1PIK3CDPIK3CG
SCHEMBL1296185 0.86 RET (1.00) KDRSRCABL1PIK3CDPIK3CG
SCHEMBL29388046 0.86 RET (1.00) KDRSRCABL1PIK3CDPIK3CG
SCHEMBL12422294 0.85 RET (0.74) KDRSRCABL1PIK3CDPIK3CG
SCHEMBL12422333 0.85 RET (0.73) KDRSRCABL1PIK3CDPIK3CG
SCHEMBL19476268 0.83 RET (0.80) KDRSRCABL1PIK3CDPIK3CG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2976086-B1 COMBINATION OF CATALYTIC MTORC 1/2 INHIBITORS AND SELECTIVE INHIBITORS OF AURORA A KINASE MILLENNIUM PHARM INC (US) 2020-10-14 — — EP disclosed
EP-3009436-B1 KINASE INHIBITORS AND METHODS OF USE INTELLIKINE LLC (US) 2019-06-05 — — EP disclosed
EP-3009436-B1 KINASE INHIBITORS AND METHODS OF USE INTELLIKINE LLC (US) 2019-06-05 — — EP disclosed
US-10172858-B2 Combination pharmaceutical compositions and uses thereof INTELLIKINE LLC (US) 2019-01-08 — — US disclosed
US-20180117060-A1 COMBINATION OF CATALYTIC MTORC 1/2 INHIBITORS AND SELECTIVE INHIBITORS OF AURORA A KINASE MILLENNIUM PHARM INC (US) 2018-05-03 — — US disclosed
US-20180117060-A1 COMBINATION OF CATALYTIC MTORC 1/2 INHIBITORS AND SELECTIVE INHIBITORS OF AURORA A KINASE MILLENNIUM PHARM INC (US) 2018-05-03 — — US disclosed
US-9828378-B2 Kinase inhibitors and methods of use INTELLIKINE LLC (US) 2017-11-28 — — US disclosed
US-9828378-B2 Kinase inhibitors and methods of use INTELLIKINE LLC (US) 2017-11-28 — — US disclosed
US-9828378-B2 Kinase inhibitors and methods of use INTELLIKINE LLC (US) 2017-11-28 — — US disclosed
US-9724354-B2 Combination of catalytic mTORC1/2 inhibitors and selective inhibitors of Aurora A kinase MILLENNIUM PHARMACEUTICALS, INC. (US) 2017-08-08 — — US disclosed
US-20110172228-A1 KINASE INHIBITORS AND METHODS OF USE INTELLIKINE LLC 2011-07-14 — — US disclosed
US-20110172228-A1 KINASE INHIBITORS AND METHODS OF USE INTELLIKINE LLC 2011-07-14 — — US disclosed
US-20110172228-A1 KINASE INHIBITORS AND METHODS OF USE INTELLIKINE LLC 2011-07-14 — — US disclosed
CN-102124009-A Kinase inhibitors and methods of use thereof INTELLIKINE INC 2011-07-13 — — CN disclosed
EP-2313414-A2 KINASE INHIBITORS AND METHODS OF USE Intellikine, Inc. (US) 2011-04-27 — — EP disclosed
WO-2010059593-A1 METHODS AND COMPOSITIONS FOR TREATMENT OF OPHTHALMIC CONDITIONS INTELLIKINE, INC. (US) 2010-05-27 — — WO disclosed
WO-2010006086-A2 KINASE INHIBITORS AND METHODS OF USE INTELLIKINE, INC. (US) 2010-01-14 — — WO disclosed
WO-2010006086-A2 KINASE INHIBITORS AND METHODS OF USE INTELLIKINE, INC. (US) 2010-01-14 — — WO disclosed
WO-2010006072-A2 MTOR MODULATORS AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2010-01-14 — — WO disclosed
WO-2010006072-A2 MTOR MODULATORS AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2010-01-14 — — 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 (3 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-20110172228-A1 KINASE INHIBITORS AND METHODS OF USE PIK3CA, MTOR, PDPK1 KDR 698/4885SRC 54/4885ABL1 73/4885
US-20180117060-A1 COMBINATION OF CATALYTIC MTORC 1/2 INHIBITORS AND SELECTIVE INHIBITORS OF AURORA A KINASE AURKC, MTOR, AURKA KDR 2868/4885SRC 1374/4885ABL1 796/4885
US-10172858-B2 Combination pharmaceutical compositions and uses thereof CDC25C, CCNC, CDC25B KDR 3481/4885SRC 825/4885ABL1 965/4885

“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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