SCHEMBL20711367

SCHEMBL20711367

CC(C)CCc1nnnn1CC(C)C

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.49
TRPV1 Q8NER1 1/20 0.42
MAPT P10636 3/20 0.38
IDE P14735 1/20 0.37
ALDH1A1 P00352 4/20 0.35
KMT2A Q03164 2/20 0.35
GAA P10253 1/20 0.35
MEN1 O00255 1/20 0.35
HTT P42858 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
NAALAD2 Q9Y3Q0 2/20 0.34
GRM2 Q14416 1/20 0.33
TOP2A P11388 1/20 0.31
LMNA P02545 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL4409119 0.85 CNR2 (0.49) CNR2TRPV1MAPTIDEALDH1A1
SCHEMBL4404533 0.81 CNR2 (0.47) CNR2TRPV1MAPTIDEALDH1A1
SCHEMBL4408212 0.80 CNR2 (0.46) CNR2TRPV1MAPTALDH1A1SMN1; SMN2
SCHEMBL4406055 0.80 CNR2 (0.51) CNR2TRPV1MAPTIDEALDH1A1
SCHEMBL4407849 0.80 CNR2 (0.51) CNR2TRPV1MAPTIDEALDH1A1
SCHEMBL4409002 0.79 CNR2 (0.44) CNR2TRPV1MAPTALDH1A1LMNA
SCHEMBL7413802 0.78 CNR2 (0.50) CNR2TRPV1MAPTIDEALDH1A1
SCHEMBL6473514 0.78 ALDH1A1 (0.38) CNR2MAPTIDEALDH1A1KMT2A
SCHEMBL4407077 0.77 CNR2 (0.49) CNR2TRPV1MAPTIDEALDH1A1
SCHEMBL96673 0.76 IDE (0.38) CNR2MAPTIDEALDH1A1KMT2A

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-10874686-B2 Anthranilyl-adenosinemonosulfamate analogs and uses thereof MEMORIAL SLOAN-KETTERING CANCER CENTER (US) 2020-12-29 US disclosed
US-20190038656-A1 ANTHRANILYL-ADENOSINEMONOSULFAMATE ANALOGS AND USES THEREOF Memorial Slooan-Kettering Cancer Center (US) 2019-02-07 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 (2 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-10874686-B2 Anthranilyl-adenosinemonosulfamate analogs and uses thereof ATIC, SLC35B2, ADORA1 CNR2 3483/4885TRPV1 1406/4885MAPT 657/4885
US-20190038656-A1 ANTHRANILYL-ADENOSINEMONOSULFAMATE ANALOGS AND USES THEREOF ATIC, SLC35B2, ADORA1 CNR2 3483/4885TRPV1 1406/4885MAPT 657/4885

“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.