SCHEMBL19612754

SCHEMBL19612754

O=C(CCCCCc1c[nH]c2ccccc12)N1CCOC1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 12/20 1.00
FAAH O00519 3/20 0.62
ALDH1A1 P00352 1/20 0.58
USP2 O75604 1/20 0.56
MAPT P10636 1/20 0.56
HPGD P15428 1/20 0.56

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
SCHEMBL19612683 0.77 NAAA (1.00) NAAAFAAH
SCHEMBL19612722 0.77 NAAA (1.00) NAAAFAAH
SCHEMBL14882056 0.77 ALDH1A1 (0.78) NAAAALDH1A1USP2MAPTHPGD
SCHEMBL16661775 0.76 NAAA (1.00) NAAAFAAH
SCHEMBL1305574 0.75 MEN1 (0.60) NAAAALDH1A1MAPTHPGD
SCHEMBL27531911 0.75 MEN1 (0.60) NAAAALDH1A1MAPTHPGD
SCHEMBL2379635 0.75 ALDH1A1 (0.67) NAAAALDH1A1MAPT
SCHEMBL5173574 0.75 ALDH1A1 (0.97) NAAAALDH1A1USP2MAPTHPGD
SCHEMBL19612658 0.74 MEN1 (0.59) NAAAALDH1A1MAPT
SCHEMBL2378991 0.74 ALDH1A1 (0.69) NAAAALDH1A1MAPT

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10174015-B2 Substituted heterocyclic derivative, preparation method and use thereof XIAMEN UNIVERSITY (CN) 2019-01-08 US disclosed
US-20170334896-A1 Substituted Heterocyclic Derivative, Preparation Method And Use Thereof XIAMEN UNIVERSITY (CN) 2017-11-23 US disclosed
US-20170334896-A1 Substituted Heterocyclic Derivative, Preparation Method And Use Thereof XIAMEN UNIVERSITY (CN) 2017-11-23 US disclosed
US-20170334896-A1 Substituted Heterocyclic Derivative, Preparation Method And Use Thereof XIAMEN UNIVERSITY (CN) 2017-11-23 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-20170334896-A1 Substituted Heterocyclic Derivative, Preparation Method And Use Thereof FAAH, NAAA, FAAH2 NAAA 2/4885FAAH 1/4885ALDH1A1 285/4885
US-10174015-B2 Substituted heterocyclic derivative, preparation method and use thereof DHPS, CYP3A5, CYP3A4 NAAA 557/4885FAAH 934/4885ALDH1A1 212/4885

“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.