SCHEMBL17916636

SCHEMBL17916636

CCn1ncc(NC2CCOC2)c(Cl)c1=O

nearest known ligand 0.60

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ KAT2B Q92831 15/20 0.60
▸ BPTF Q12830 5/20 0.46
▸ BRD4 O60885 1/20 0.46
▸ PDE1A P54750 1/20 0.43
▸ PDE1B Q01064 1/20 0.43
▸ PDE1C Q14123 1/20 0.43

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
SCHEMBL17916626 0.84 KAT2B (0.67) KAT2BBPTF
SCHEMBL17916632 0.80 BPTF (0.69) KAT2BBPTFBRD4
SCHEMBL17916631 0.78 BPTF (0.72) KAT2BBPTFBRD4
SCHEMBL17916635 0.77 KAT2B (0.67) KAT2BBPTF
SCHEMBL17916637 0.76 KAT2B (0.73) KAT2BBPTF
SCHEMBL17916727 0.75 KAT2B (1.00) KAT2BBPTF
SCHEMBL4947871 0.71 PDE4B (0.50) PDE1APDE1BPDE1C
SCHEMBL17916705 0.70 BPTF (0.70) KAT2BBPTF
SCHEMBL22574641 0.70 PDE1B (0.60) PDE1APDE1BPDE1C
SCHEMBL25355683 0.67 KAT2B (0.42) KAT2BBPTF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10239861-B2 Therapeutic compounds and uses thereof GENETECH, INC. (US) 2019-03-26 — — US disclosed
US-20180037566-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2018-02-08 — — US disclosed
US-20180037566-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2018-02-08 — — US disclosed
WO-2016112298-A1 PYRIDAZINONE DERIVATIVES AND THEIR USE IN THE TREATMENT OF CANCER GENENTECH, INC. (US) 2016-07-14 — — 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-10239861-B2 Therapeutic compounds and uses thereof HDAC10, HDAC6, HDAC11 KAT2B 103/4885BPTF 20/4885BRD4 1320/4885
US-20180037566-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF HDAC10, HDAC6, HDAC11 KAT2B 103/4885BPTF 20/4885BRD4 1320/4885

“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