SCHEMBL20008981

SCHEMBL20008981

CC(C)c1cn(C(C)C(=O)N(C)C)cn1

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CPA1 P15085 1/20 0.34
CPB2 Q96IY4 1/20 0.34
CCNC P24863 3/20 0.33
CDK8 P49336 3/20 0.33
KDM5A P29375 1/20 0.32

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
SCHEMBL21064707 0.85 KDM5A (0.33) CCNCCDK8KDM5A
SCHEMBL20012745 0.78 KDM5A (0.31) CCNCCDK8KDM5A
SCHEMBL12039663 0.72 CPA1 (0.41) CPA1CPB2KDM5A
SCHEMBL20012481 0.70 OPRM1 (0.32)
SCHEMBL23115030 0.69 CPA1 (0.31) CPA1CPB2
SCHEMBL20907767 0.69 CPA1 (0.31) CPA1CPB2
SCHEMBL18081255 0.68 CCNC (0.47) CCNCCDK8
SCHEMBL17297334 0.68 CCNC (0.47) CCNCCDK8
SCHEMBL18081259 0.68 CCNC (0.47) CCNCCDK8
SCHEMBL11839667 0.68 CCNC (0.39) CCNCCDK8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10308614-B2 Therapeutic compounds and uses thereof GENENTECH, INC. (US) 2019-06-04 US disclosed
US-20180086720-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2018-03-29 US disclosed
US-20180086720-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2018-03-29 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 (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-10308614-B2 Therapeutic compounds and uses thereof SMARCC1, SMARCC2, SMARCA4 CPA1 4227/4885CPB2 3251/4885CCNC 3381/4885
US-20180086720-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF SMARCC1, SMARCC2, SMARCA4 CPA1 4227/4885CPB2 3251/4885CCNC 3381/4885

“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.