SCHEMBL19504486

SCHEMBL19504486

COC1CN(c2ccc3c(n2)CN(C(C)C)C3)C1

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PDE10A Q9Y233 2/20 0.37
▸ CCNC P24863 1/20 0.36
▸ CDK8 P49336 1/20 0.36
▸ HRH3 Q9Y5N1 8/20 0.33
▸ MAP4K4 O95819 2/20 0.33
▸ ACACB O00763 3/20 0.31
▸ MAP3K12 Q12852 1/20 0.31

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
SCHEMBL17624443 0.83 CCNC (0.41) PDE10ACCNCCDK8HRH3MAP4K4
SCHEMBL19498195 0.80 PDE10A (0.40) PDE10ACCNCCDK8MAP4K4
SCHEMBL19504484 0.78 PDE10A (0.37) PDE10ACCNCCDK8HRH3MAP4K4
SCHEMBL19504487 0.75 HRH3 (0.40) HRH3
SCHEMBL19504663 0.72 DRD2 (0.36) PDE10AHRH3
SCHEMBL27251619 0.70 EGFR (0.32) —
SCHEMBL20651750 0.68 KCNH2 (0.32) —
SCHEMBL20651755 0.68 DRD2 (0.33) —
SCHEMBL19505171 0.66 TIPARP (0.47) HRH3ACACB
SCHEMBL20651756 0.65 SLC6A9 (0.42) PDE10AHRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170305922-A1 CARM1 INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2017-10-26 — — 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 (1 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-20170305922-A1 CARM1 INHIBITORS AND USES THEREOF CARM1, ADRM1, PRMT1 PDE10A 3114/4885CCNC 4074/4885CDK8 1036/4885

“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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