SCHEMBL26828845

SCHEMBL26828845

CC(C)(C)c1cnc2ncc(CC(C)(C)c3cnc4cnccc4c3)cc2c1

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HPGDS O60760 1/20 0.33
TRPV1 Q8NER1 3/20 0.33
MAOB P27338 1/20 0.31
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 1/20 0.30
SLC6A2 P23975 1/20 0.30
SLC6A4 P31645 1/20 0.30
SLC6A3 Q01959 1/20 0.30
KCNH2 Q12809 1/20 0.30

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
SCHEMBL13619364 0.81 HPGDS (0.43) HPGDSTRPV1
SCHEMBL19386405 0.78 HPGDS (0.40) HPGDSMAOBCYP3A4CYP2D6SLC6A2
SCHEMBL22446609 0.77 TRPV1 (0.36) TRPV1CYP3A4CYP2D6SLC6A2SLC6A4
SCHEMBL19802020 0.77 HPGDS (0.33) HPGDSTRPV1
SCHEMBL26828848 0.74
SCHEMBL21497380 0.70 GNRHR (0.41) TRPV1KCNH2
SCHEMBL10078199 0.70 LATS1 (0.39) HPGDS
SCHEMBL10249921 0.70 KIF11 (0.38) TRPV1
SCHEMBL24542822 0.70 MAOB (0.36) MAOB
SCHEMBL20932780 0.69 ALDH1A1 (0.39) TRPV1MAOBCYP3A4CYP2D6SLC6A2

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-20230382909-A1 BICYCLIC COMPOUNDS ALIGOS THERAPEUTICS, INC. 2023-11-30 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-20230382909-A1 BICYCLIC COMPOUNDS SLC10A1, PKD1, CYP11B2 HPGDS 2524/4885TRPV1 796/4885MAOB 1212/4885

“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.