SCHEMBL17557002

SCHEMBL17557002

CCC[C@H]1CC[C@H](Cc2cccnc2OC(=O)O)CC1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ SSTR4 P31391 2/20 0.39
▸ SLC13A5 Q86YT5 4/20 0.38
▸ IDH1 O75874 1/20 0.38
▸ MAPT P10636 2/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ FFAR4 Q5NUL3 1/20 0.35
▸ ALDH1A1 P00352 3/20 0.34
▸ LMNA P02545 1/20 0.34
▸ DRD2 P14416 1/20 0.34
▸ DRD3 P35462 1/20 0.34
▸ KIF18A Q8NI77 1/20 0.34
▸ HAO1 Q9UJM8 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ HTR1A P08908 1/20 0.33
▸ ADRA2A P08913 1/20 0.33
▸ ADRA2B P18089 1/20 0.33
▸ ADRA2C P18825 1/20 0.33

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
SCHEMBL17556999 0.91 SSTR4 (0.40) SSTR4SLC13A5IDH1MAPTCYP2C9
SCHEMBL16057305 0.80 P2RX7 (0.43) SSTR4FFAR4
SCHEMBL28736458 0.78 SLC13A5 (0.45) SSTR4SLC13A5MAPTALDH1A1LMNA
SCHEMBL16056855 0.76 SLC13A5 (0.42) SLC13A5
SCHEMBL17556834 0.76 SSTR4 (0.44) SSTR4MAPTCYP2C9
SCHEMBL17556833 0.76 SSTR4 (0.44) SSTR4MAPTCYP2C9
SCHEMBL16058433 0.75 CYSLTR2 (0.44) SLC13A5
SCHEMBL16057512 0.75 CYSLTR2 (0.42) SLC13A5
SCHEMBL16057820 0.74 CYSLTR2 (0.46) SLC13A5
SCHEMBL17557003 0.74 IDO1 (0.42) MAPTCYP2C9ALDH1A1LMNA

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-9828338-B2 Carbamate derivatives of lactam based N-acylethanolamine acid amidase (NAAA) inhibitors THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2017-11-28 — — US disclosed
US-20160068482-A1 CARBAMATE DERIVATIVES OF LACTAM BASED N-ACYLETHANOLAMINE ACID AMIDASE (NAAA) INHIBITORS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2016-03-10 — — 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-20160068482-A1 CARBAMATE DERIVATIVES OF LACTAM BASED N-ACYLETHANOLAMINE ACID AMIDASE (NAAA) INHIBITORS NAAA, FAAH, FAAH2 SSTR4 4376/4885SLC13A5 2298/4885IDH1 2951/4885

“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.

Send feedback