SCHEMBL19498569

SCHEMBL19498569

CC(C)(C)N1Cc2ccc(N3CC(F)C3)nc2C1

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ HPGDS O60760 1/20 0.34
▸ HTR2A P28223 1/20 0.33
▸ HTR2C P28335 1/20 0.33
▸ PDE10A Q9Y233 3/20 0.32
▸ CHRM3 P20309 1/20 0.32
▸ PDE4A P27815 1/20 0.32
▸ PDE4B Q07343 1/20 0.32
▸ PDE4C Q08493 1/20 0.32
▸ PDE4D Q08499 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
SCHEMBL19498196 0.87 CHRM3 (0.33) HTR2AHTR2CPDE10ACHRM3PDE4A
SCHEMBL17624445 0.83 HTR2A (0.36) HPGDSHTR2AHTR2CPDE10ACHRM3
SCHEMBL19498195 0.83 PDE10A (0.40) PDE10A
SCHEMBL19498181 0.80 HTR2A (0.42) HTR2AHTR2C
SCHEMBL19498563 0.77 MAPT (0.34) PDE10A
SCHEMBL19498194 0.77 GAA (0.43) HTR2AHTR2C
SCHEMBL19498162 0.71 CYP1A2 (0.32) HTR2AHTR2C
SCHEMBL16639804 0.69 DRD2 (0.34) —
SCHEMBL19498567 0.69 ABHD6 (0.43) HTR2AHTR2C
SCHEMBL19498187 0.67 DRD2 (0.37) HTR2AHTR2CPDE10A

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 2 patents. 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
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 HPGDS 3796/4885HTR2A 4298/4885HTR2C 4771/4885

“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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