SCHEMBL19658487

SCHEMBL19658487

CC(=O)N(C)CC1CCN(CC2CCCCC2)CC1

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ACHE P22303 7/20 0.50
SMN1; SMN2 Q16637 1/20 0.49
CHRM5 P08912 1/20 0.47
ADRA2C P18825 1/20 0.47
HTR4 Q13639 5/20 0.40

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
SCHEMBL19658480 0.98 ACHE (0.47) ACHESMN1; SMN2CHRM5ADRA2CHTR4
SCHEMBL19658671 0.95 ACHE (0.43) ACHESMN1; SMN2CHRM5ADRA2CHTR4
SCHEMBL12010818 0.87 CHRM5 (0.46) ACHESMN1; SMN2CHRM5ADRA2C
SCHEMBL19658599 0.85 KDM4E (0.40) ACHEHTR4
SCHEMBL19658485 0.85 ACHE (0.44) ACHEHTR4
SCHEMBL2718690 0.85 ALOX5 (0.48)
SCHEMBL19652209 0.84 ACHE (0.46) ACHESMN1; SMN2CHRM5ADRA2CHTR4
SCHEMBL19658670 0.83 MGLL (0.39) ACHESMN1; SMN2HTR4
SCHEMBL28003016 0.83 ACHE (0.51) ACHESMN1; SMN2CHRM5ADRA2C
SCHEMBL19658488 0.82 ACHE (0.44) ACHESMN1; SMN2CHRM5ADRA2CHTR4

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-20170340604-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2017-11-30 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-20170340604-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF BRD4, BRDT, BRD3 ACHE 2649/4885SMN1; SMN2 1221/4885CHRM5 1660/4885

“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.