SCHEMBL13609541

SCHEMBL13609541

COc1ccc(F)c(-c2cc3nnc(N)nc3cc2C)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DHFR P00374 2/20 0.50
▸ PDE2A O00408 4/20 0.43
▸ PDE10A Q9Y233 4/20 0.43
▸ PDE6D O43924 1/20 0.43
▸ PDE6A P16499 1/20 0.43
▸ PDE6G P18545 1/20 0.43
▸ PDE4A P27815 1/20 0.43
▸ PDE6B P35913 1/20 0.43
▸ PDE6C P51160 1/20 0.43
▸ PDE4B Q07343 1/20 0.43
▸ PDE4C Q08493 1/20 0.43
▸ PDE4D Q08499 1/20 0.43
▸ PDE3B Q13370 1/20 0.43
▸ PDE6H Q13956 1/20 0.43
▸ PDE3A Q14432 1/20 0.43
▸ AMY1A P0DUB6 1/20 0.41
▸ SRC P12931 4/20 0.40
▸ POLQ O75417 1/20 0.39
▸ NPC1 O15118 2/20 0.38
▸ PDGFRB P09619 1/20 0.37

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
SCHEMBL4264367 0.85 DHFR (0.50) DHFRPDE2APDE10ASRCNPC1
SCHEMBL4268061 0.75 SRC (0.43) DHFRPDE2APDE10ASRCNPC1
SCHEMBL4271184 0.75 HSP90AA1 (0.53) DHFRPDE2APDE10ASRCNPC1
SCHEMBL5995026 0.74 MEN1 (0.56) SRCNPC1PIK3CGAPP
SCHEMBL12221098 0.69 ALDH1A1 (0.44) PDE2APDE10APDE6DPDE6APDE6G
SCHEMBL13609525 0.69 SRC (0.46) DHFRPDE2APDE10ASRCPIK3CG
SCHEMBL4273050 0.68 SRC (0.57) DHFRPDE2APDE10ASRCNPC1
SCHEMBL4275233 0.67 SRC (0.43) DHFRSRCPDGFRBPIK3CG
SCHEMBL8530021 0.67 DHFR (1.00) DHFR
SCHEMBL29419518 0.66 KDM1A (0.45) PDE2APDE10APDE6DPDE6APDE6G

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
US-8481536-B2 Benzotriazine inhibitors of kinases TARGEGEN, INC. (US) 2013-07-09 — — US disclosed
US-8481536-B2 Benzotriazine inhibitors of kinases TARGEGEN, INC. (US) 2013-07-09 — — US disclosed
EP-2543376-A1 Benzotriazine inhibitors of kinases Targegen, Inc. (US) 2013-01-09 — — EP disclosed
US-20110294796-A1 BENZOTRIAZINE INHIBITORS OF KINASES TARGEGEN, INC. (US) 2011-12-01 — — US disclosed
US-20110294796-A1 BENZOTRIAZINE INHIBITORS OF KINASES TARGEGEN, INC. (US) 2011-12-01 — — US disclosed
US-20090275569-A1 Benzotriazine Inhibitors of Kinases TARGEGEN, INC. 2009-11-05 — — US disclosed
US-20090275569-A1 Benzotriazine Inhibitors of Kinases TARGEGEN, INC. 2009-11-05 — — US disclosed
US-7456176-B2 Benzotriazine inhibitors of kinases TARGEGEN, INC. (US) 2008-11-25 — — US disclosed
US-7456176-B2 Benzotriazine inhibitors of kinases TARGEGEN, INC. (US) 2008-11-25 — — 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 (2 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-20110294796-A1 BENZOTRIAZINE INHIBITORS OF KINASES SRC, CAMK4, CAMK2G DHFR 1676/4885PDE2A 2690/4885PDE10A 2796/4885
US-20090275569-A1 Benzotriazine Inhibitors of Kinases SRC, CAMK4, CAMK2G DHFR 1676/4885PDE2A 2690/4885PDE10A 2796/4885

“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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