SCHEMBL20952906

SCHEMBL20952906

CCc1n[nH]c2c1CN(C)CCC2

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CYP2C19 P33261 1/20 0.51
▸ HCAR2 Q8TDS4 1/20 0.34
▸ HTT P42858 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ PARP1 P09874 1/20 0.32
▸ GAA P10253 1/20 0.31
▸ CREBBP Q92793 2/20 0.31
▸ EP300 Q09472 1/20 0.31
▸ BRD4 O60885 1/20 0.31
▸ JAK2 O60674 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
SCHEMBL17234920 0.83 CYP2C19 (0.36) CYP2C19HCAR2HTTHSD17B10
SCHEMBL20053807 0.79 HMOX1 (0.35) CYP2C19HCAR2HTTHSD17B10PARP1
SCHEMBL17232654 0.78 CYP2C19 (0.56) CYP2C19HCAR2JAK2
SCHEMBL20053806 0.78 CREBBP (0.50) CREBBPEP300BRD4
SCHEMBL19297272 0.77 CYP2C19 (0.51) CYP2C19HCAR2JAK2
SCHEMBL13948699 0.77 HCAR2 (0.44) HCAR2HTTHSD17B10GAA
SCHEMBL14048246 0.77 HCAR2 (0.44) HCAR2HTTHSD17B10GAA
SCHEMBL19831875 0.77 CREBBP (0.53) HCAR2PARP1CREBBPEP300BRD4
SCHEMBL17229730 0.75 CYP2C19 (0.57) CYP2C19HCAR2HSD17B10GAAJAK2
SCHEMBL17221260 0.75 CYP2C19 (0.62) CYP2C19HSD17B10GAACREBBPBRD4

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-10273243-B2 4-phenylpiperidines, their preparation and use THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2019-04-30 — — 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-10273243-B2 4-phenylpiperidines, their preparation and use HTR3C, HRH4, CYP4F3 CYP2C19 117/4885HCAR2 983/4885HTT 559/4885

“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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