SCHEMBL16092559

SCHEMBL16092559

CC(C)c1c(-c2ccc(OCC3CC3)cc2)[nH]c2c(C#N)cnn2c1=O

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ GRM2 Q14416 1/20 0.44
▸ KDM5A P29375 7/20 0.38
▸ KDM5B Q9UGL1 2/20 0.38
▸ KDM5C P41229 1/20 0.38
▸ KDM1A O60341 1/20 0.37
▸ EGLN2 Q96KS0 1/20 0.37
▸ PLAT P00750 2/20 0.37
▸ ADORA2B P29275 2/20 0.35
▸ HTR1B P28222 1/20 0.35
▸ OPRK1 P41145 1/20 0.35
▸ FFAR4 Q5NUL3 1/20 0.35
▸ SIGMAR1 Q99720 1/20 0.35
▸ ACACB O00763 2/20 0.35
▸ XDH P47989 1/20 0.35

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
SCHEMBL17547853 0.89 CSNK2B (0.39) GRM2KDM5AKDM5BKDM5CPLAT
SCHEMBL16092251 0.85 SMN1; SMN2 (0.45) GRM2KDM5AKDM5BKDM5C
SCHEMBL16092431 0.84 KDM5A (0.46) KDM5AKDM5BKDM5C
SCHEMBL16092242 0.84 KDM5B (0.44) KDM5AKDM5BKDM5CPLAT
SCHEMBL16092319 0.83 PLAT (0.42) KDM5APLAT
SCHEMBL17547840 0.82 KDM5A (0.48) GRM2KDM5AKDM5BKDM5C
SCHEMBL16092317 0.82 KDM5A (0.48) KDM5AKDM5BKDM5CPLAT
SCHEMBL16092329 0.82 KDM5A (0.55) KDM5AKDM5BKDM5C
SCHEMBL16092368 0.81 KDM5B (0.47) KDM5AKDM5BKDM1APLAT
SCHEMBL16092471 0.81 KDM5B (0.49) KDM5AKDM5BKDM5CPLAT

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 GRM2 1530/4885KDM5A 1/4885KDM5B 3/4885
US-20160060267-A1 PYRAZOLO COMPOUNDS AND USES THEREOF KDM5A, KDM5C, KDM5B GRM2 1530/4885KDM5A 1/4885KDM5B 3/4885

“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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