SCHEMBL16092528

SCHEMBL16092528

CC(=O)N1CCN(c2ccc(-c3[nH]c4c(C#N)cnn4c(=O)c3C(C)C)cc2)CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RET P07949 10/20 0.47
▸ EGLN2 Q96KS0 1/20 0.40
▸ FLT3 P36888 3/20 0.39
▸ CDK7 P50613 3/20 0.39
▸ CCNH P51946 3/20 0.39
▸ CDK2 P24941 3/20 0.39
▸ MNAT1 P51948 2/20 0.39
▸ CCNE1 P24864 2/20 0.39
▸ TLR8 Q9NR97 1/20 0.38
▸ TLR7 Q9NYK1 1/20 0.38
▸ CASP6 P55212 1/20 0.38
▸ GFER P55789 1/20 0.38
▸ CDK1 P06493 3/20 0.38
▸ CCNB1 P14635 3/20 0.38
▸ CDK4 P11802 1/20 0.37
▸ CCND1 P24385 1/20 0.37
▸ CCNT1 O60563 1/20 0.37
▸ CCNA2 P20248 1/20 0.37
▸ CDK9 P50750 1/20 0.37
▸ CCNA1 P78396 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
SCHEMBL17547849 0.90 KDM5B (0.45) RETTLR8TLR7
SCHEMBL17547830 0.89 KDM5B (0.45) EGLN2CASP6KDM4ELMNAMAPT
SCHEMBL16092441 0.89 KDM5B (0.45) RETCDK9
SCHEMBL17547834 0.88 RET (0.52) RETEGLN2LMNAMAPT
SCHEMBL16092522 0.82 MEN1 (0.40) EGLN2TLR8TLR7LMNATSHR
SCHEMBL16092242 0.82 KDM5B (0.44) —
SCHEMBL16092317 0.82 KDM5A (0.48) —
SCHEMBL16092534 0.81 EGLN1 (0.43) KDM4E
SCHEMBL16092513 0.81 KDM5A (0.46) KDM4EGAAMAPK1
SCHEMBL16092523 0.81 KDM5A (0.49) CDK1CCNB1KDM4ELMNAGAA

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 RET 2286/4885EGLN2 148/4885FLT3 855/4885
US-20160060267-A1 PYRAZOLO COMPOUNDS AND USES THEREOF KDM5A, KDM5C, KDM5B RET 2286/4885EGLN2 148/4885FLT3 855/4885

“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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