SCHEMBL21391646

SCHEMBL21391646

CC(C)C1=NC(C(C)C)CN1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 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
SCHEMBL21391758 0.79
SCHEMBL21391830 0.74
SCHEMBL13290621 0.73
Hydrochloric Acid SCHEMBL17821472 0.70
SCHEMBL13735000 0.70
SCHEMBL21391800 0.70
SCHEMBL22864327 0.62 NOS3 (0.32)
SCHEMBL21322305 0.61 PDCD1 (0.32)
Hydrochloric Acid SCHEMBL9326277 0.60 PDCD1 (0.31)
Hydrochloric Acid SCHEMBL30914668 0.58 PDCD1 (0.30)

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-20210017162-A1 NEURITE OUTGROWTH PROMOTERS AND USES THEREOF UNIVERSITY OF MIAMI 2021-01-21 US disclosed
WO-2019183369-A1 NEURITE OUTGROWTH PROMOTERS AND USES THEREOF UNIVERSITY OF MIAMI (US) 2019-09-26 WO 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-20210017162-A1 NEURITE OUTGROWTH PROMOTERS AND USES THEREOF BDNF, NGF, GAP43 NPC1 839/4885

“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.