SCHEMBL16092562

SCHEMBL16092562

CC(C)n1cc(-c2[nH]c3c(C#N)cnn3c(=O)c2C2(C)CCC2)cn1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KDM5A P29375 7/20 0.41
▸ JAK2 O60674 1/20 0.38
▸ TYK2 P29597 1/20 0.38
▸ KDM5B Q9UGL1 3/20 0.33
▸ PLAT P00750 2/20 0.33
▸ BRD4 O60885 2/20 0.32
▸ CREBBP Q92793 2/20 0.32
▸ KDM4D Q6B0I6 1/20 0.32
▸ ALOX5AP P20292 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30

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
SCHEMBL16092563 0.82 KDM5B (0.46) KDM5AJAK2TYK2KDM5BPLAT
SCHEMBL16092352 0.81 KDM5A (0.53) KDM5AJAK2TYK2KDM5BPLAT
SCHEMBL16050500 0.78 KDM5A (0.46) KDM5AJAK2TYK2KDM5BPLAT
SCHEMBL16092308 0.76 KDM5A (0.42) KDM5AJAK2TYK2KDM5BPLAT
SCHEMBL16092504 0.73 KDM5A (0.40) KDM5AJAK2TYK2PLATBRD4
SCHEMBL16092410 0.73 KDM5A (0.45) KDM5AKDM5B
SCHEMBL16050937 0.73 KDM5A (0.39) KDM5AKDM5BPLAT
SCHEMBL17547799 0.71 KDM5A (0.43) KDM5AKDM5B
SCHEMBL16092253 0.71 KDM5A (0.53) KDM5AKDM5BPLAT
SCHEMBL17547822 0.69 KDM5A (0.44) KDM5AKDM5B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10035801-B2 Pyrazolo compounds and uses thereof GENENTECH, INC. (US) 2018-07-31 — — US disclosed
US-10035801-B2 Pyrazolo compounds and uses thereof GENENTECH, INC. (US) 2018-07-31 — — US disclosed
US-20160060267-A1 PYRAZOLO COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2016-03-03 — — US disclosed
US-20160060267-A1 PYRAZOLO COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2016-03-03 — — US disclosed
WO-2015135094-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2015-09-17 — — WO disclosed
WO-2014139326-A1 PYRAZOLO COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2014-09-18 — — 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 (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-10035801-B2 Pyrazolo compounds and uses thereof KDM5A, KDM5C, KDM5B KDM5A 1/4885JAK2 367/4885TYK2 418/4885
US-20160060267-A1 PYRAZOLO COMPOUNDS AND USES THEREOF KDM5A, KDM5C, KDM5B KDM5A 1/4885JAK2 367/4885TYK2 418/4885

“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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