SCHEMBL16534837

SCHEMBL16534837

CCc1c(C)[nH]c2c(-n3ccnc3)cnn2c1=O

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PDE4A P27815 4/20 0.38
▸ PDE4B Q07343 4/20 0.38
▸ PDE4C Q08493 4/20 0.38
▸ PDE4D Q08499 4/20 0.38
▸ EGLN2 Q96KS0 1/20 0.37
▸ CA12 O43570 1/20 0.33
▸ CA9 Q16790 1/20 0.33
▸ KDM5A P29375 1/20 0.33
▸ GRIK1 P39086 1/20 0.33
▸ GRIA1 P42261 1/20 0.33
▸ GRIA2 P42262 1/20 0.33
▸ GRIA3 P42263 1/20 0.33
▸ GRIA4 P48058 1/20 0.33
▸ GRIK2 Q13002 1/20 0.33
▸ GRIK3 Q13003 1/20 0.33
▸ GRIK4 Q16099 1/20 0.33
▸ GRIK5 Q16478 1/20 0.33

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
SCHEMBL16534878 0.82 MEN1 (0.36) PDE4APDE4BPDE4CPDE4D
SCHEMBL16535307 0.79 PDE4A (0.38) PDE4APDE4BPDE4CPDE4DKDM5A
SCHEMBL16535509 0.79 KDM5A (0.32) KDM5A
SCHEMBL16535079 0.78 KDM4E (0.32) EGLN2
SCHEMBL16534729 0.78 EED (0.30) —
SCHEMBL16534823 0.77 KDM5A (0.34) KDM5A
SCHEMBL16535286 0.77 MEN1 (0.40) —
SCHEMBL16534881 0.77 CYP2C19 (0.45) KDM5A
SCHEMBL16534745 0.76 MAP4K1 (0.33) —
SCHEMBL16534874 0.76 PARP1 (0.32) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3041474-B1 ANTIPROLIFERATIVE COMPOUNDS GENENTECH INC (US) 2020-03-18 — — EP disclosed
US-9505767-B2 Pyrazolo[1,5-A]pyrimidin-7(4H)-onehistone demethylase inhibitors GENENTECH, INC. (US) 2016-11-29 — — US disclosed
US-9505767-B2 Pyrazolo[1,5-A]pyrimidin-7(4H)-onehistone demethylase inhibitors GENENTECH, INC. (US) 2016-11-29 — — US disclosed
US-9505767-B2 Pyrazolo[1,5-A]pyrimidin-7(4H)-onehistone demethylase inhibitors GENENTECH, INC. (US) 2016-11-29 — — US disclosed
EP-3041474-A1 ANTIPROLIFERATIVE COMPOUNDS Genentech, Inc. (US) 2016-07-13 — — EP disclosed
WO-2015035062-A1 ANTIPROLIFERATIVE COMPOUNDS GENENTECH, INC. (US) 2015-03-12 — — WO disclosed
WO-2015035062-A1 ANTIPROLIFERATIVE COMPOUNDS GENENTECH, INC. (US) 2015-03-12 — — WO disclosed
US-20150065522-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. 2015-03-05 — — US disclosed
US-20150065522-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. 2015-03-05 — — US disclosed
US-20150065522-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. 2015-03-05 — — 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 (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-20150065522-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF KDM5A, KDM5B, KDM5C PDE4A 679/4885PDE4B 411/4885PDE4C 680/4885

“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.

Send feedback